Chemical Properties of Benzaldehyde, 4-(1-methylethyl)- (CAS 122-03-2)

Benzaldehyde, 4-(1-methylethyl)-

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InChI
InChI=1S/C10H12O/c1-8(2)10-5-3-9(7-11)4-6-10/h3-8H,1-2H3
InChI Key
WTWBUQJHJGUZCY-UHFFFAOYSA-N
Formula
C10H12O
SMILES
CC(C)c1ccc(C=O)cc1
Molecular Weight1
148.20
CAS
122-03-2
Other Names
  • 4-(1-Methylethyl)benzaldehyde
  • 4-Isopropylbenzaldehyde
  • 4-Isopropylphenylcarboxaldehyde
  • 4-iPr-Benzaldehyde
  • Benzaldehyde, p-isopropyl-
  • Cumal
  • Cumaldehyde
  • Cumic aldehyde
  • Cuminal
  • Cuminaldehyde
  • Cuminic aldehyde
  • Cuminyl aldehyde
  • NSC 4886
  • p-(1-methylethyl)benzaldehyde
  • p-Cumic aldehyde
  • p-Cuminic aldehyde
  • p-Isopropylbenzaldehyde
  • p-Isopropylbenzenecarboxaldehyde

Physical Properties

Property Value Unit Source
Δf 34.14 kJ/mol Joback Calculated Property
Δfgas -115.53 kJ/mol Joback Calculated Property
Δfus 14.07 kJ/mol Joback Calculated Property
Δvap 47.12 kJ/mol Joback Calculated Property
log10WS -2.90 Crippen Calculated Property
logPoct/wat 2.623 Crippen Calculated Property
McVol 129.570 ml/mol McGowan Calculated Property
Pc 3156.17 kPa Joback Calculated Property
Inp [1188.00; 1284.00]   Show Hide
Inp 1218.00 NIST
Inp 1218.00 NIST
Inp 1226.00 NIST
Inp 1240.00 NIST
Inp 1242.00 NIST
Inp 1239.00 NIST
Inp 1246.00 NIST
Inp 1218.00 NIST
Inp 1249.00 NIST
Inp 1226.00 NIST
Inp 1257.00 NIST
Inp 1243.10 NIST
Inp 1202.00 NIST
Inp 1239.00 NIST
Inp 1239.00 NIST
Inp 1239.00 NIST
Inp 1237.00 NIST
Inp 1211.00 NIST
Inp Outlier 1188.00 NIST
Inp 1237.00 NIST
Inp 1235.00 NIST
Inp 1214.00 NIST
Inp 1242.00 NIST
Inp 1240.00 NIST
Inp 1216.00 NIST
Inp 1215.00 NIST
Inp 1211.00 NIST
Inp 1235.00 NIST
Inp 1232.00 NIST
Inp 1215.00 NIST
Inp 1239.00 NIST
Inp 1209.00 NIST
Inp 1205.00 NIST
Inp 1238.00 NIST
Inp 1239.00 NIST
Inp 1240.00 NIST
Inp 1240.00 NIST
Inp 1205.00 NIST
Inp 1211.00 NIST
Inp Outlier 1195.00 NIST
Inp 1246.00 NIST
Inp 1240.00 NIST
Inp 1239.00 NIST
Inp 1242.00 NIST
Inp 1239.00 NIST
Inp Outlier 1267.00 NIST
Inp 1207.00 NIST
Inp 1239.00 NIST
Inp 1248.00 NIST
Inp 1236.00 NIST
Inp 1239.00 NIST
Inp 1239.00 NIST
Inp 1211.00 NIST
Inp 1240.00 NIST
Inp 1202.00 NIST
Inp 1215.00 NIST
Inp 1241.00 NIST
Inp 1246.50 NIST
Inp 1236.00 NIST
Inp Outlier 1265.00 NIST
Inp 1242.00 NIST
Inp 1242.00 NIST
Inp 1244.00 NIST
Inp 1240.00 NIST
Inp 1237.00 NIST
Inp 1236.00 NIST
Inp 1217.00 NIST
Inp 1246.00 NIST
Inp 1248.00 NIST
Inp 1251.00 NIST
Inp 1255.00 NIST
Inp 1201.00 NIST
Inp 1226.00 NIST
Inp 1239.00 NIST
Inp 1242.00 NIST
Inp 1234.00 NIST
Inp 1245.00 NIST
Inp 1240.00 NIST
Inp 1240.00 NIST
Inp 1218.00 NIST
Inp 1212.00 NIST
Inp 1239.00 NIST
Inp 1238.00 NIST
Inp 1256.00 NIST
Inp 1235.00 NIST
Inp 1239.00 NIST
Inp 1250.00 NIST
Inp 1213.00 NIST
Inp 1240.00 NIST
Inp 1239.00 NIST
Inp 1221.00 NIST
Inp 1237.00 NIST
Inp 1224.00 NIST
Inp 1236.00 NIST
Inp 1224.00 NIST
Inp 1247.00 NIST
Inp 1240.00 NIST
Inp 1202.00 NIST
Inp 1240.00 NIST
Inp 1220.00 NIST
Inp 1234.00 NIST
Inp 1222.00 NIST
Inp 1237.00 NIST
Inp 1217.00 NIST
Inp 1228.00 NIST
Inp 1236.00 NIST
Inp 1214.00 NIST
Inp 1249.00 NIST
Inp 1236.00 NIST
Inp 1224.00 NIST
Inp Outlier 1284.00 NIST
Inp 1252.00 NIST
Inp 1238.00 NIST
Inp 1221.00 NIST
Inp 1239.00 NIST
Inp 1221.00 NIST
Inp 1239.00 NIST
Inp Outlier 1192.00 NIST
Inp 1240.00 NIST
Inp 1241.00 NIST
Inp 1239.00 NIST
Inp 1224.00 NIST
Inp 1224.00 NIST
Inp 1255.00 NIST
Inp 1240.00 NIST
Inp 1234.00 NIST
Inp 1239.00 NIST
Inp 1223.00 NIST
Inp 1216.00 NIST
Inp 1239.00 NIST
Inp 1241.00 NIST
Inp 1203.00 NIST
Inp 1240.00 NIST
Inp 1235.60 NIST
Inp 1239.00 NIST
Inp 1227.00 NIST
Inp 1208.00 NIST
Inp 1216.00 NIST
Inp 1219.00 NIST
Inp 1218.00 NIST
Inp 1219.00 NIST
Inp Outlier 1191.00 NIST
Inp 1203.00 NIST
Inp 1238.00 NIST
Inp 1200.00 NIST
Inp 1237.00 NIST
Inp 1238.00 NIST
Inp 1239.00 NIST
Inp 1243.00 NIST
Inp 1238.00 NIST
Inp 1247.00 NIST
Inp 1238.00 NIST
Inp Outlier 1279.00 NIST
Inp 1228.00 NIST
Inp 1232.00 NIST
Inp 1200.00 NIST
Inp 1242.00 NIST
Inp 1215.00 NIST
Inp 1258.00 NIST
Inp 1238.00 NIST
Inp 1216.00 NIST
Inp 1242.00 NIST
Inp 1246.00 NIST
Inp 1242.00 NIST
Inp 1200.00 NIST
Inp 1235.00 NIST
Inp 1226.00 NIST
Inp 1235.00 NIST
Inp Outlier 1189.00 NIST
Inp 1215.00 NIST
Inp 1200.00 NIST
Inp 1212.00 NIST
Inp 1200.00 NIST
Inp 1214.00 NIST
Inp 1226.00 NIST
Inp 1227.00 NIST
Inp 1240.00 NIST
Inp 1248.00 NIST
Inp 1239.00 NIST
Inp 1256.00 NIST
Inp 1236.00 NIST
Inp 1217.00 NIST
Inp 1221.00 NIST
Inp 1255.00 NIST
Inp 1216.00 NIST
Inp 1235.60 NIST
Inp 1219.00 NIST
I [1738.00; 1831.00]   Show Hide
I 1811.00 NIST
I 1795.00 NIST
I 1814.00 NIST
I 1786.00 NIST
I 1782.00 NIST
I 1779.00 NIST
I 1774.00 NIST
I 1789.00 NIST
I Outlier 1748.00 NIST
I 1794.00 NIST
I 1760.00 NIST
I 1789.00 NIST
I Outlier 1747.00 NIST
I 1785.00 NIST
I 1780.00 NIST
I 1781.00 NIST
I 1771.00 NIST
I 1759.00 NIST
I 1781.00 NIST
I 1763.00 NIST
I Outlier 1831.00 NIST
I 1775.00 NIST
I 1790.00 NIST
I 1791.00 NIST
I 1776.00 NIST
I 1753.00 NIST
I 1762.00 NIST
I 1751.00 NIST
I 1767.00 NIST
I 1794.00 NIST
I 1763.00 NIST
I 1776.00 NIST
I 1783.00 NIST
I 1784.00 NIST
I 1769.00 NIST
I 1785.00 NIST
I 1802.00 NIST
I 1776.00 NIST
I 1791.00 NIST
I 1760.00 NIST
I 1786.00 NIST
I 1804.00 NIST
I 1800.00 NIST
I 1766.00 NIST
I 1781.00 NIST
I 1798.00 NIST
I 1802.00 NIST
I 1785.00 NIST
I 1802.00 NIST
I 1802.00 NIST
I 1802.00 NIST
I 1802.00 NIST
I 1802.00 NIST
I 1802.00 NIST
I 1802.00 NIST
I 1764.00 NIST
I 1802.00 NIST
I 1802.00 NIST
I 1802.00 NIST
I 1802.00 NIST
I 1805.00 NIST
I Outlier 1738.00 NIST
I 1802.00 NIST
I 1802.00 NIST
I 1802.00 NIST
I 1804.00 NIST
I 1802.00 NIST
I 1802.00 NIST
I 1802.00 NIST
I 1802.00 NIST
I 1802.00 NIST
I 1804.00 NIST
I 1804.00 NIST
I 1805.00 NIST
I 1767.00 NIST
I 1765.00 NIST
I 1766.00 NIST
I 1763.00 NIST
I 1776.00 NIST
I 1794.00 NIST
I 1769.00 NIST
I 1760.00 NIST
I 1781.00 NIST
I 1811.00 NIST
Tboil [508.65; 508.70] K Show Hide
Tboil 508.70 K NIST
Tboil 508.65 ± 1.00 K NIST
Tc 723.60 K Joback Calculated Property
Tfus 268.40 K Joback Calculated Property
Vc 0.498 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [278.08; 348.24] J/mol×K [508.08; 723.60] Show Hide
Cp,gas 278.08 J/mol×K 508.08 Joback Calculated Property
Cp,gas 291.66 J/mol×K 544.00 Joback Calculated Property
Cp,gas 304.45 J/mol×K 579.92 Joback Calculated Property
Cp,gas 316.47 J/mol×K 615.84 Joback Calculated Property
Cp,gas 327.76 J/mol×K 651.76 Joback Calculated Property
Cp,gas 338.34 J/mol×K 687.68 Joback Calculated Property
Cp,gas 348.24 J/mol×K 723.60 Joback Calculated Property
η [0.0002564; 0.0033646] Pa×s [268.40; 508.08] Show Hide
η 0.0033646 Pa×s 268.40 Joback Calculated Property
η 0.0016592 Pa×s 308.35 Joback Calculated Property
η 0.0009623 Pa×s 348.29 Joback Calculated Property
η 0.0006243 Pa×s 388.24 Joback Calculated Property
η 0.0004391 Pa×s 428.19 Joback Calculated Property
η 0.0003279 Pa×s 468.13 Joback Calculated Property
η 0.0002564 Pa×s 508.08 Joback Calculated Property
ΔvapH 55.30 kJ/mol 418.00 NIST

Pressure Dependent Properties

Property Value Unit Pressure (kPa) Source
Tboilr 376.70 K 1.30 NIST

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.64] kPa [377.05; 539.94] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.57194e+01
Coefficient B-5.20755e+03
Coefficient C-3.95980e+01
Temperature range, min.377.05
Temperature range, max.539.94
Pvap 1.33 kPa 377.05 Calculated Property
Pvap 2.92 kPa 395.15 Calculated Property
Pvap 5.94 kPa 413.25 Calculated Property
Pvap 11.32 kPa 431.35 Calculated Property
Pvap 20.36 kPa 449.45 Calculated Property
Pvap 34.84 kPa 467.54 Calculated Property
Pvap 57.08 kPa 485.64 Calculated Property
Pvap 90.00 kPa 503.74 Calculated Property
Pvap 137.12 kPa 521.84 Calculated Property
Pvap 202.64 kPa 539.94 Calculated Property

Similar Compounds

Ethanone, 1-[4-(1-methylethyl)phenyl]-. Benzene, 1,4-bis(1-methylethyl)-. 1-Tert-butyl-4-isopropylbenzene. Benzene, 1-(1-methylethyl)-4-(1,1-dimethylethyl). Benzoic acid, 4-(1-methylethyl)-. 4-tert-butylbenzaldehyde. 3-Isopropylbenzaldehyde. Benzonitrile, 4-(1-methylethyl)-. p-Cymene. d14 Cymene. Benzene, 1-ethyl-4-(1-methylethyl)-. Methanone, [4-(1-methylethyl)phenyl]phenyl-. Benzene, (1-methylethyl)-. Benzoic acid, 4-(1-methylethyl)-, methyl ester. Benzene, 1-iodo-4-(1-methylethyl)-.

Find more compounds similar to Benzaldehyde, 4-(1-methylethyl)-.

Sources

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.

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