Chemical Properties of Thymol (CAS 89-83-8)

Thymol

InChI
InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3
InChI Key
MGSRCZKZVOBKFT-UHFFFAOYSA-N
Formula
C10H14O
SMILES
Cc1ccc(C(C)C)c(O)c1
Molecular Weight1
150.22
CAS
89-83-8
Other Names
  • 1-Hydroxy-5-methyl-2-isopropylbenzene
  • 1-methyl-3-hydroxy-4-isopropylbenzene
  • 2-Hydroxy-1-isopropyl-4-methylbenzene
  • 2-Isopropyl-5-methylphenol (thymol)
  • 2-isopropyl-5-methylphenol
  • 3-Hydroxy-1-methyl-4-isopropylbenzene
  • 3-hydroxy-p-cymene
  • 3-methyl-6-isopropylphenol
  • 3-p-cymenol
  • 5-Methyl-2-isopropyl-1-phenol
  • 5-methyl-2-(1-methylethyl)phenol
  • 5-methyl-2-isopropylphenol
  • 6-Isopropyl-3-methylphenol
  • 6-Isopropyl-m-cresol
  • Isopropyl-m-cresol
  • NSC 11215
  • Phenol, 2-isopropyl-5-methyl-
  • Thymic acid
  • m-Cresol, 6-isopropyl-
  • m-thymol
  • p-Cymene, 3-hydroxy-
  • p-cymen-3-ol
  • phenol, 5-methyl-2-(1-methylethyl)-
  • thyme camphor
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Physical Properties

Property Value Unit Source
ω 0.5372 Relay (1.0) Calculated Property
ΔcH°solid [-5657.00; -5626.20] kJ/mol Show Hide
ΔcH°solid -5657.00 kJ/mol NIST
ΔcH°solid -5626.20 ± 9.60 kJ/mol NIST
ΔfH°gas -184.60 kJ/mol NIST
ΔfH°solid -280.00 kJ/mol NIST
ΔfusH° 17.57 kJ/mol Joback Calculated Property
ΔsubH° [91.50; 95.73] kJ/mol Show Hide
ΔsubH° 95.73 kJ/mol NIST
ΔsubH° 95.40 kJ/mol NIST
ΔsubH° 91.50 kJ/mol NIST
ΔvapH° [68.70; 70.90] kJ/mol Show Hide
ΔvapH° 70.90 kJ/mol NIST
ΔvapH° 68.70 kJ/mol NIST
ΔvapH° 70.50 kJ/mol NIST
IE 7.98 eV Relay (1.0) Calculated Property
log10WS -2.22 Estimated Solubility
logPoct/wat 2.824 Crippen Calculated Property
McVol 133.870 ml/mol McGowan Calculated Property
Pc 3439.94 kPa Joback Calculated Property
Inp [1239.00; 1328.00]   Show Hide
Inp 1265.51 NIST
Inp 1264.78 NIST
Inp 1264.48 NIST
Inp 1264.64 NIST
Inp 1265.21 NIST
Inp 1265.21 NIST
Inp 1266.17 NIST
Inp 1267.44 NIST
Inp 1269.09 NIST
Inp 1271.04 NIST
Inp 1271.04 NIST
Inp 1268.59 NIST
Inp 1266.79 NIST
Inp 1265.51 NIST
Inp 1264.72 NIST
Inp 1264.40 NIST
Inp 1264.54 NIST
Inp 1265.09 NIST
Inp 1266.02 NIST
Inp 1267.31 NIST
Inp 1274.53 NIST
Inp 1271.67 NIST
Inp 1268.62 NIST
Inp 1266.78 NIST
Inp 1265.10 NIST
Inp 1291.00 NIST
Inp 1291.00 NIST
Inp 1292.00 NIST
Inp 1293.00 NIST
Inp 1294.00 NIST
Inp 1295.00 NIST
Inp 1292.00 NIST
Inp 1291.00 NIST
Inp 1292.00 NIST
Inp 1292.00 NIST
Inp 1292.00 NIST
Inp 1293.00 NIST
Inp 1294.00 NIST
Inp 1296.00 NIST
Inp 1293.00 NIST
Inp 1292.00 NIST
Inp 1283.00 NIST
Inp 1292.00 NIST
Inp 1297.00 NIST
Inp 1275.00 NIST
Inp 1290.00 NIST
Inp 1292.00 NIST
Inp 1287.00 NIST
Inp Outlier 1311.00 NIST
Inp 1288.00 NIST
Inp 1302.00 NIST
Inp 1296.00 NIST
Inp 1296.00 NIST
Inp 1292.00 NIST
Inp 1298.00 NIST
Inp 1260.00 NIST
Inp 1280.00 NIST
Inp 1281.00 NIST
Inp 1272.00 NIST
Inp 1290.00 NIST
Inp 1272.00 NIST
Inp 1284.00 NIST
Inp 1290.00 NIST
Inp 1296.00 NIST
Inp 1292.00 NIST
Inp 1284.00 NIST
Inp 1287.00 NIST
Inp 1288.00 NIST
Inp 1280.00 NIST
Inp 1306.00 NIST
Inp 1299.00 NIST
Inp 1284.00 NIST
Inp 1268.00 NIST
Inp 1290.00 NIST
Inp 1288.00 NIST
Inp 1308.00 NIST
Inp 1271.00 NIST
Inp 1266.00 NIST
Inp 1292.00 NIST
Inp 1291.00 NIST
Inp 1266.00 NIST
Inp 1279.00 NIST
Inp 1292.00 NIST
Inp 1291.00 NIST
Inp 1267.00 NIST
Inp 1267.00 NIST
Inp 1290.00 NIST
Inp 1291.00 NIST
Inp 1270.00 NIST
Inp 1292.00 NIST
Inp 1286.00 NIST
Inp 1293.00 NIST
Inp 1266.00 NIST
Inp 1285.00 NIST
Inp 1290.00 NIST
Inp 1280.00 NIST
Inp 1268.00 NIST
Inp 1302.00 NIST
Inp 1290.00 NIST
Inp 1293.00 NIST
Inp 1285.00 NIST
Inp 1282.00 NIST
Inp 1264.00 NIST
Inp 1296.00 NIST
Inp 1267.00 NIST
Inp 1286.00 NIST
Inp 1286.00 NIST
Inp 1283.00 NIST
Inp 1267.00 NIST
Inp 1290.00 NIST
Inp 1299.00 NIST
Inp 1289.00 NIST
Inp 1267.00 NIST
Inp 1281.00 NIST
Inp 1286.00 NIST
Inp 1291.00 NIST
Inp 1296.00 NIST
Inp 1290.00 NIST
Inp 1290.00 NIST
Inp 1280.00 NIST
Inp 1294.00 NIST
Inp 1294.00 NIST
Inp 1289.00 NIST
Inp 1290.00 NIST
Inp 1291.00 NIST
Inp 1291.00 NIST
Inp 1292.00 NIST
Inp 1272.00 NIST
Inp 1292.00 NIST
Inp 1291.00 NIST
Inp 1269.00 NIST
Inp 1291.00 NIST
Inp 1291.00 NIST
Inp 1280.00 NIST
Inp 1294.00 NIST
Inp 1290.00 NIST
Inp 1290.00 NIST
Inp Outlier 1253.00 NIST
Inp 1294.00 NIST
Inp 1290.00 NIST
Inp 1295.00 NIST
Inp 1290.00 NIST
Inp 1290.00 NIST
Inp 1292.00 NIST
Inp 1289.00 NIST
Inp 1292.00 NIST
Inp 1285.00 NIST
Inp 1290.00 NIST
Inp 1290.00 NIST
Inp 1290.00 NIST
Inp 1263.00 NIST
Inp 1290.00 NIST
Inp 1263.00 NIST
Inp 1292.00 NIST
Inp 1293.00 NIST
Inp 1290.00 NIST
Inp 1289.00 NIST
Inp 1290.00 NIST
Inp 1272.00 NIST
Inp 1290.00 NIST
Inp 1297.00 NIST
Inp 1291.00 NIST
Inp 1294.00 NIST
Inp 1294.00 NIST
Inp 1290.00 NIST
Inp 1266.00 NIST
Inp 1266.00 NIST
Inp 1266.00 NIST
Inp 1295.00 NIST
Inp 1279.70 NIST
Inp 1287.00 NIST
Inp 1285.00 NIST
Inp 1273.00 NIST
Inp Outlier 1254.20 NIST
Inp 1265.40 NIST
Inp 1277.00 NIST
Inp Outlier 1310.00 NIST
Inp 1267.00 NIST
Inp 1268.00 NIST
Inp 1265.00 NIST
Inp 1303.00 NIST
Inp 1280.00 NIST
Inp 1272.00 NIST
Inp 1290.00 NIST
Inp 1290.00 NIST
Inp 1294.00 NIST
Inp 1290.00 NIST
Inp 1290.00 NIST
Inp 1290.00 NIST
Inp 1298.00 NIST
Inp 1267.00 NIST
Inp 1293.00 NIST
Inp 1292.00 NIST
Inp 1302.00 NIST
Inp 1290.00 NIST
Inp 1295.00 NIST
Inp 1293.00 NIST
Inp 1278.00 NIST
Inp 1273.00 NIST
Inp 1289.00 NIST
Inp 1291.00 NIST
Inp 1271.00 NIST
Inp 1295.00 NIST
Inp 1294.00 NIST
Inp 1281.00 NIST
Inp 1293.00 NIST
Inp 1295.00 NIST
Inp 1290.00 NIST
Inp 1290.00 NIST
Inp 1293.00 NIST
Inp 1294.00 NIST
Inp 1267.00 NIST
Inp 1272.00 NIST
Inp 1294.00 NIST
Inp 1290.00 NIST
Inp 1273.00 NIST
Inp 1294.00 NIST
Inp 1294.00 NIST
Inp 1267.00 NIST
Inp 1308.00 NIST
Inp 1279.00 NIST
Inp 1290.00 NIST
Inp 1294.00 NIST
Inp 1290.00 NIST
Inp 1294.00 NIST
Inp 1288.00 NIST
Inp 1269.00 NIST
Inp 1283.00 NIST
Inp 1265.00 NIST
Inp 1294.00 NIST
Inp 1301.00 NIST
Inp 1289.00 NIST
Inp 1269.00 NIST
Inp 1293.00 NIST
Inp 1290.00 NIST
Inp 1290.00 NIST
Inp 1279.00 NIST
Inp 1291.00 NIST
Inp 1262.00 NIST
Inp 1266.00 NIST
Inp 1291.00 NIST
Inp 1264.00 NIST
Inp 1266.00 NIST
Inp 1266.00 NIST
Inp 1304.00 NIST
Inp 1270.00 NIST
Inp 1290.00 NIST
Inp 1270.00 NIST
Inp 1290.00 NIST
Inp 1290.00 NIST
Inp 1292.00 NIST
Inp 1292.00 NIST
Inp 1293.00 NIST
Inp 1292.00 NIST
Inp 1274.00 NIST
Inp 1303.00 NIST
Inp 1285.00 NIST
Inp 1290.00 NIST
Inp Outlier 1254.00 NIST
Inp 1291.00 NIST
Inp 1290.00 NIST
Inp 1263.00 NIST
Inp 1290.00 NIST
Inp Outlier 1314.00 NIST
Inp 1290.00 NIST
Inp 1270.00 NIST
Inp 1282.00 NIST
Inp 1270.00 NIST
Inp 1290.00 NIST
Inp 1289.00 NIST
Inp 1304.00 NIST
Inp 1290.00 NIST
Inp 1287.00 NIST
Inp 1290.00 NIST
Inp 1292.00 NIST
Inp 1288.00 NIST
Inp 1268.00 NIST
Inp 1267.00 NIST
Inp 1290.00 NIST
Inp 1268.00 NIST
Inp 1290.00 NIST
Inp 1290.00 NIST
Inp 1294.00 NIST
Inp 1270.00 NIST
Inp 1263.00 NIST
Inp 1295.00 NIST
Inp 1266.00 NIST
Inp Outlier 1251.00 NIST
Inp 1282.00 NIST
Inp 1266.00 NIST
Inp 1298.00 NIST
Inp 1286.00 NIST
Inp 1292.00 NIST
Inp 1292.00 NIST
Inp 1278.00 NIST
Inp 1267.00 NIST
Inp 1268.00 NIST
Inp 1269.00 NIST
Inp 1275.00 NIST
Inp 1282.00 NIST
Inp 1267.00 NIST
Inp 1290.00 NIST
Inp 1290.00 NIST
Inp 1288.00 NIST
Inp Outlier 1316.00 NIST
Inp 1290.00 NIST
Inp 1268.00 NIST
Inp 1274.00 NIST
Inp 1304.00 NIST
Inp Outlier 1256.00 NIST
Inp 1284.00 NIST
Inp 1260.00 NIST
Inp 1292.00 NIST
Inp 1286.00 NIST
Inp 1267.00 NIST
Inp 1293.00 NIST
Inp 1285.00 NIST
Inp 1272.00 NIST
Inp 1278.00 NIST
Inp 1278.00 NIST
Inp 1290.00 NIST
Inp 1290.00 NIST
Inp 1292.00 NIST
Inp 1292.00 NIST
Inp 1276.00 NIST
Inp 1268.00 NIST
Inp 1290.00 NIST
Inp 1292.00 NIST
Inp 1291.00 NIST
Inp 1288.00 NIST
Inp 1304.00 NIST
Inp Outlier 1328.00 NIST
Inp 1292.00 NIST
Inp 1293.00 NIST
Inp 1290.00 NIST
Inp 1300.00 NIST
Inp 1290.00 NIST
Inp Outlier 1255.00 NIST
Inp 1263.00 NIST
Inp Outlier 1251.00 NIST
Inp 1295.00 NIST
Inp 1274.00 NIST
Inp 1273.00 NIST
Inp 1266.00 NIST
Inp 1290.00 NIST
Inp 1268.00 NIST
Inp 1268.00 NIST
Inp 1262.00 NIST
Inp 1262.00 NIST
Inp 1271.00 NIST
Inp 1295.00 NIST
Inp 1299.00 NIST
Inp 1272.00 NIST
Inp 1269.00 NIST
Inp 1284.00 NIST
Inp 1274.00 NIST
Inp 1274.00 NIST
Inp 1286.00 NIST
Inp 1293.00 NIST
Inp 1271.00 NIST
Inp 1273.00 NIST
Inp 1272.00 NIST
Inp 1284.00 NIST
Inp 1289.00 NIST
Inp 1268.00 NIST
Inp 1270.00 NIST
Inp 1284.00 NIST
Inp 1290.00 NIST
Inp 1275.00 NIST
Inp 1288.00 NIST
Inp 1269.00 NIST
Inp 1286.00 NIST
Inp 1286.00 NIST
Inp 1287.00 NIST
Inp 1268.00 NIST
Inp 1267.00 NIST
Inp 1268.00 NIST
Inp 1267.00 NIST
Inp 1265.00 NIST
Inp 1268.00 NIST
Inp 1265.00 NIST
Inp 1265.00 NIST
Inp 1268.00 NIST
Inp 1268.00 NIST
Inp 1278.00 NIST
Inp 1275.00 NIST
Inp 1275.00 NIST
Inp 1302.00 NIST
Inp 1264.00 NIST
Inp 1290.00 NIST
Inp 1290.00 NIST
Inp 1301.00 NIST
Inp 1291.00 NIST
Inp 1292.00 NIST
Inp 1292.00 NIST
Inp 1290.00 NIST
Inp 1290.00 NIST
Inp 1289.00 NIST
Inp 1290.00 NIST
Inp 1293.00 NIST
Inp 1262.00 NIST
Inp 1292.00 NIST
Inp 1293.00 NIST
Inp 1275.00 NIST
Inp 1275.00 NIST
Inp 1293.00 NIST
Inp 1293.00 NIST
Inp 1289.00 NIST
Inp 1289.00 NIST
Inp 1295.00 NIST
Inp 1303.00 NIST
Inp 1288.00 NIST
Inp 1289.00 NIST
Inp 1290.00 NIST
Inp 1293.00 NIST
Inp 1290.00 NIST
Inp 1260.00 NIST
Inp 1293.00 NIST
Inp 1293.00 NIST
Inp 1296.00 NIST
Inp 1292.00 NIST
Inp 1290.00 NIST
Inp Outlier 1240.00 NIST
Inp 1290.00 NIST
Inp Outlier 1241.00 NIST
Inp Outlier 1241.00 NIST
Inp 1293.00 NIST
Inp Outlier 1318.00 NIST
Inp 1308.00 NIST
Inp 1290.00 NIST
Inp 1308.00 NIST
Inp 1288.00 NIST
Inp 1290.00 NIST
Inp 1290.00 NIST
Inp 1290.00 NIST
Inp 1280.00 NIST
Inp 1275.00 NIST
Inp 1275.00 NIST
Inp 1276.00 NIST
Inp Outlier 1239.00 NIST
Inp 1290.00 NIST
Inp 1275.00 NIST
Inp 1290.00 NIST
Inp 1272.00 NIST
Inp 1267.00 NIST
Inp 1267.00 NIST
Inp 1298.00 NIST
Inp 1275.00 NIST
Inp 1290.00 NIST
Inp 1290.00 NIST
Inp 1290.00 NIST
Inp 1293.00 NIST
Inp 1291.00 NIST
Inp 1308.00 NIST
Inp 1275.00 NIST
Inp 1290.00 NIST
Inp 1268.00 NIST
Inp 1290.00 NIST
Inp 1308.00 NIST
Inp 1290.00 NIST
Inp 1290.00 NIST
Inp 1290.00 NIST
Inp 1292.00 NIST
Inp 1290.00 NIST
Inp 1291.00 NIST
Inp 1267.00 NIST
Inp 1290.00 NIST
Inp 1269.00 NIST
Inp 1272.00 NIST
Inp 1278.00 NIST
Inp 1275.00 NIST
Inp 1270.00 NIST
Inp 1263.00 NIST
Inp 1270.00 NIST
Inp 1267.00 NIST
Inp 1297.00 NIST
Inp 1289.00 NIST
Inp 1273.00 NIST
Inp 1271.00 NIST
Inp 1287.00 NIST
Inp 1260.00 NIST
Inp 1270.00 NIST
Inp 1298.00 NIST
Inp 1290.00 NIST
Inp 1289.00 NIST
Inp 1281.00 NIST
Inp 1293.00 NIST
Inp 1308.00 NIST
Inp 1294.00 NIST
Inp 1266.00 NIST
Inp 1304.00 NIST
Inp 1274.00 NIST
Inp 1291.00 NIST
Inp 1292.00 NIST
Inp 1268.00 NIST
Inp 1263.00 NIST
Inp 1278.00 NIST
Inp 1282.00 NIST
Inp Outlier 1316.00 NIST
Inp Outlier 1256.00 NIST
Inp 1267.00 NIST
Inp 1276.00 NIST
Inp 1288.00 NIST
Inp Outlier 1251.00 NIST
Inp 1271.00 NIST
Inp 1284.00 NIST
Inp 1303.00 NIST
Inp 1287.00 NIST
Inp 1296.00 NIST
Inp 1302.00 NIST
Inp 1264.00 NIST
Inp 1283.00 NIST
Inp 1272.00 NIST
Inp Outlier 1253.00 NIST
Inp 1273.00 NIST
Ip [2139.00; 2212.00]   Show Hide
Ip 2173.00 NIST
Ip 2212.00 NIST
Ip 2198.00 NIST
Ip 2189.00 NIST
Ip 2186.00 NIST
Ip 2157.00 NIST
Ip 2157.00 NIST
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Ip 2183.00 NIST
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Ip 2164.00 NIST
Ip 2187.00 NIST
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Ip 2180.00 NIST
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Ip 2154.00 NIST
Ip 2172.00 NIST
Ip 2172.00 NIST
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Ip 2189.00 NIST
Ip 2189.00 NIST
Ip 2163.00 NIST
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Ip 2156.00 NIST
Ip 2152.00 NIST
Ip 2149.00 NIST
Ip 2191.00 NIST
Ip 2187.00 NIST
Ip 2177.00 NIST
Ip Outlier 2145.00 NIST
Ip 2207.00 NIST
Ip 2171.00 NIST
Ip 2180.00 NIST
Ip 2162.00 NIST
Ip 2167.00 NIST
Ip 2198.00 NIST
Ip 2174.00 NIST
Ip 2178.00 NIST
Ip 2185.00 NIST
Ip 2189.00 NIST
Ip 2189.00 NIST
Ip 2202.00 NIST
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Ip 2175.00 NIST
Ip 2200.00 NIST
Ip 2179.00 NIST
Ip 2180.00 NIST
Ip 2178.00 NIST
Ip 2188.00 NIST
Ip 2153.00 NIST
Ip Outlier 2143.00 NIST
Ip 2191.00 NIST
Ip 2166.00 NIST
Ip 2185.00 NIST
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Ip 2198.00 NIST
Ip 2189.00 NIST
Ip 2198.00 NIST
Ip 2205.00 NIST
Ip 2189.00 NIST
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Ip 2205.00 NIST
Ip 2205.00 NIST
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Ip 2172.00 NIST
Ip 2205.00 NIST
Ip 2195.00 NIST
Ip 2148.00 NIST
Ip 2205.00 NIST
Ip 2153.00 NIST
Ip 2198.00 NIST
Ip Outlier 2139.00 NIST
Ip 2198.00 NIST
Ip 2198.00 NIST
Ip 2198.00 NIST
Ip 2198.00 NIST
Ip 2162.00 NIST
Ip 2167.00 NIST
Ip 2198.00 NIST
Ip 2198.00 NIST
Ip 2151.00 NIST
Ip 2198.00 NIST
Ip 2198.00 NIST
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Ip 2198.00 NIST
Ip 2198.00 NIST
Ip 2198.00 NIST
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Ip 2198.00 NIST
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Ip 2205.00 NIST
Ip 2205.00 NIST
Ip 2198.00 NIST
Ip 2198.00 NIST
Ip 2169.00 NIST
Ip 2198.00 NIST
Ip 2198.00 NIST
Ip 2198.00 NIST
Ip 2198.00 NIST
Ip 2198.00 NIST
Ip 2198.00 NIST
Ip 2198.00 NIST
Ip 2198.00 NIST
Ip 2198.00 NIST
Ip 2198.00 NIST
Ip 2198.00 NIST
Ip 2198.00 NIST
Ip 2198.00 NIST
Ip 2173.00 NIST
Ip 2205.00 NIST
Ip 2198.00 NIST
Ip 2205.00 NIST
Ip 2198.00 NIST
Ip 2205.00 NIST
Ip 2205.00 NIST
Ip 2174.00 NIST
Ip Outlier 2142.00 NIST
Ip Outlier 2146.00 NIST
Ip 2205.00 NIST
Ip 2205.00 NIST
Ip 2205.00 NIST
Ip 2185.00 NIST
Ip 2191.00 NIST
Ip Outlier 2146.00 NIST
Ip 2198.00 NIST
Ip 2151.00 NIST
Ip 2205.00 NIST
Ip 2174.00 NIST
Tboil [504.65; 506.65] K Show Hide
Tboil 506.20 K NIST
Tboil 506.05 ± 0.30 K NIST
Tboil 506.05 ± 0.35 K NIST
Tboil 505.65 ± 0.30 K NIST
Tboil 506.15 ± 3.00 K NIST
Tboil 505.95 ± 2.00 K NIST
Tboil 506.00 ± 0.50 K NIST
Tboil Outlier 504.65 ± 4.00 K NIST
Tboil 506.65 ± 1.00 K NIST
Tc [698.00; 698.30] K Show Hide
Tc 698.00 K IUPAC Vapor-Liquid Critical Properties of Elements and Compounds, part 7 Compiled value
Tc 698.30 ± 4.00 K NIST
Tfus [321.70; 324.65] K Show Hide
Tfus 323.10 K (Solid + liquid) equilibrium phase diagrams in binary mixtures containing terpenes: New experimental data and analysis of several modelling strategies with modified UNIFAC (Dortmund) and PC-SAFT equation of state
Tfus 324.15 K Liquid pharmaceuticals formulation by eutectic formation
Tfus 322.00 K Solubility of high-value compounds in ethyl lactate: Measurements and modelling
Tfus 322.65 K Solubility and solution thermodynamics of thymol in six pure organic solvents
Tfus 322.65 K Low-density polyethylene-thymol: Thermal behavior and phase diagram
Tfus 324.15 K Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) Compiled value
Tfus 324.00 ± 1.00 K NIST
Tfus 322.80 ± 0.50 K NIST
Tfus 322.90 ± 0.50 K NIST
Tfus 322.65 ± 3.00 K NIST
Tfus Outlier 324.65 ± 2.00 K NIST
Tfus 322.00 ± 1.50 K NIST
Tfus 323.70 ± 1.50 K NIST
Tfus 322.35 ± 0.30 K NIST
Tfus 322.35 ± 0.30 K NIST
Tfus 322.10 ± 2.00 K NIST
Tfus 322.83 ± 0.40 K NIST
Tfus 321.70 ± 0.50 K NIST
Vc 0.467 m3/kmol Relay (1.0) Calculated Property

Cheméo can also estimate Standard Gibbs free energy of formation for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
ΔfusH [22.01; 22.01] kJ/mol [324.20; 324.20] Show Hide
ΔfusH 22.01 kJ/mol 324.20 NIST
ΔfusH 22.01 kJ/mol 324.20 NIST
ΔsubH [75.10; 91.20] kJ/mol [284.00; 308.00] Show Hide
ΔsubH 75.10 kJ/mol 284.00 NIST
ΔsubH 91.20 ± 4.10 kJ/mol 293.00 NIST
ΔsubH 89.10 ± 4.50 kJ/mol 308.00 NIST
ΔvapH [51.50; 63.20] kJ/mol [421.00; 447.50] Show Hide
ΔvapH 54.90 kJ/mol 421.00 NIST
ΔvapH 63.20 kJ/mol 426.50 NIST
ΔvapH 58.40 kJ/mol 426.50 NIST
ΔvapH 55.20 kJ/mol 426.50 NIST
ΔvapH 52.80 kJ/mol 426.50 NIST
ΔvapH 51.50 kJ/mol 426.50 NIST
ΔvapH 58.40 kJ/mol 447.50 NIST

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [179.49; 436.63] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-3.64100e+01
Coefficient B9.75960e-01
Coefficient C-7.43920e-04
Coefficient D2.41000e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 179.49 J/mol×K 273.00 Calculated Property
Cp,gas 226.43 J/mol×K 353.78 Calculated Property
Cp,gas 266.99 J/mol×K 434.56 Calculated Property
Cp,gas 301.96 J/mol×K 515.33 Calculated Property
Cp,gas 332.07 J/mol×K 596.11 Calculated Property
Cp,gas 358.10 J/mol×K 676.89 Calculated Property
Cp,gas 380.81 J/mol×K 757.67 Calculated Property
Cp,gas 400.96 J/mol×K 838.44 Calculated Property
Cp,gas 419.31 J/mol×K 919.22 Calculated Property
Cp,gas 436.63 J/mol×K 1000.00 Calculated Property
Property Value Unit Temperature (K) Source
η [0.0059760; 0.0001117] Pa×s [322.83; 488.70] Joback Predicted correlation Show Hide
EquationY = exp(A + B/T + C·ln(T) + D·T^E)
Y is η in Pa×s, T in K
Coefficient A-1.68439e+01
Coefficient B3.78480e+03
Coefficient C0.00000e+00
Coefficient D0.00000e+00
Coefficient E0.00000e+00
CommentLiquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.322.83
Temperature range, max.488.70
η 0.0059760 Pa×s 322.83 Calculated Property
η 0.0031726 Pa×s 341.26 Calculated Property
η 0.0017973 Pa×s 359.69 Calculated Property
η 0.0010761 Pa×s 378.12 Calculated Property
η 0.0006758 Pa×s 396.55 Calculated Property
η 0.0004423 Pa×s 414.98 Calculated Property
η 0.0003001 Pa×s 433.41 Calculated Property
η 0.0002102 Pa×s 451.84 Calculated Property
η 0.0001514 Pa×s 470.27 Calculated Property
η 0.0001117 Pa×s 488.70 Calculated Property
Property Value Unit Temperature (K) Source
Pvap [1.33; 202.65] kPa [384.52; 534.65] The Yaws Handbook of Vapor Pressure Show Hide
Equationln(Y) = A + B/(T + C)
Y is Pvap in kPa, T in K
Coefficient A1.54443e+01
Coefficient B-4.58942e+03
Coefficient C-8.17210e+01
Temperature range, min.384.52
Temperature range, max.534.65
Pvap 1.33 kPa 384.52 Calculated Property
Pvap 2.94 kPa 401.20 Calculated Property
Pvap 6.00 kPa 417.88 Calculated Property
Pvap 11.44 kPa 434.56 Calculated Property
Pvap 20.58 kPa 451.24 Calculated Property
Pvap 35.19 kPa 467.93 Calculated Property
Pvap 57.56 kPa 484.61 Calculated Property
Pvap 90.54 kPa 501.29 Calculated Property
Pvap 137.56 kPa 517.97 Calculated Property
Pvap 202.65 kPa 534.65 Calculated Property
Pvap [1.35; 129.66] kPa [381.15; 514.15] KDB Vapor Pressure Data Show Hide
Equationln(Y) = A + B/T + C·ln(T) + D·T² + E/T²
Y is Pvap in kPa, T in K
Coefficient A1.14571e+02
Coefficient B-1.18006e+04
Coefficient C-1.41836e+01
Coefficient D6.75881e-06
Coefficient E0.00000e+00
Temperature range, min.381.15
Temperature range, max.514.15
Pvap 1.35 kPa 381.15 Calculated Property
Pvap 2.69 kPa 395.93 Calculated Property
Pvap 5.07 kPa 410.71 Calculated Property
Pvap 9.06 kPa 425.48 Calculated Property
Pvap 15.44 kPa 440.26 Calculated Property
Pvap 25.24 kPa 455.04 Calculated Property
Pvap 39.78 kPa 469.82 Calculated Property
Pvap 60.66 kPa 484.59 Calculated Property
Pvap 89.85 kPa 499.37 Calculated Property
Pvap 129.66 kPa 514.15 Calculated Property
Pvap [0.13; 99.92] kPa [337.50; 505.00] NIST Show Hide
Equationln(Y) = A + B/(T + C)
Y is Pvap in kPa, T in K
Coefficient A1.67949e+01
Coefficient B-5.80788e+03
Coefficient C-2.85750e+01
ReferenceStull, 1947
CommentCoefficents calculated by NIST from author's data.
Temperature range, min.337.50
Temperature range, max.505.00
Pvap 0.13 kPa 337.50 Calculated Property
Pvap 0.39 kPa 356.11 Calculated Property
Pvap 1.02 kPa 374.72 Calculated Property
Pvap 2.39 kPa 393.33 Calculated Property
Pvap 5.18 kPa 411.94 Calculated Property
Pvap 10.45 kPa 430.56 Calculated Property
Pvap 19.81 kPa 449.17 Calculated Property
Pvap 35.56 kPa 467.78 Calculated Property
Pvap 60.87 kPa 486.39 Calculated Property
Pvap 99.92 kPa 505.00 Calculated Property
Property Value Unit Temperature (K) Source
γ [0.03; 0.01] N/m [322.15; 505.15] Jasper (1972), surface tension of pure liquid compounds Compiled value Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is γ in N/m, T in K
Coefficient A5.63756e-02
Coefficient B-8.21000e-05
Coefficient C0.00000e+00
Coefficient D0.00000e+00
Coefficient E0.00000e+00
Temperature range, min.322.15
Temperature range, max.505.15
γ 0.03 N/m 322.15 Calculated Property
γ 0.03 N/m 342.48 Calculated Property
γ 0.03 N/m 362.82 Calculated Property
γ 0.02 N/m 383.15 Calculated Property
γ 0.02 N/m 403.48 Calculated Property
γ 0.02 N/m 423.82 Calculated Property
γ 0.02 N/m 444.15 Calculated Property
γ 0.02 N/m 464.48 Calculated Property
γ 0.02 N/m 484.82 Calculated Property
γ 0.01 N/m 505.15 Calculated Property

Similar Compounds

Phenol, 2,5-bis(1-methylethyl)-. Thymohydroquinone. Phenol, 2-ethyl-5-methyl-. Phenol, 2-methyl-5-(1-methylethyl)-. Phenol, 2-(1-methylethyl)-. Phenol, 2-(1,1-dimethylethyl)-5-methyl-. 2,5-Diethylphenol. Benzene, 2-methoxy-4-methyl-1-(1-methylethyl)-. Phenol, 4-methyl-2-(1-methylethyl)-. Thymyl formate. 2-Ethyl-5-n-propylphenol. Phenol, 4-chloro-5-methyl-2-(1-methylethyl)-. Phenol, 5-methyl-2-(1-methylethyl)-, acetate. Phenol, 2,4-bis(1-methylethyl)-. Phenol, 2,5-bis(1-methylpropyl)-.

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Mixtures

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Sources

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