Chemical Properties of Nonanoic acid (CAS 112-05-0)

Nonanoic acid

InChI
InChI=1S/C9H18O2/c1-2-3-4-5-6-7-8-9(10)11/h2-8H2,1H3,(H,10,11)
InChI Key
FBUKVWPVBMHYJY-UHFFFAOYSA-N
Formula
C9H18O2
SMILES
CCCCCCCCC(=O)O
Molecular Weight1
158.24
CAS
112-05-0
Other Names
  • 1-Nonanoic acid
  • 1-Octanecarboxylic acid
  • Cirrasol 185a
  • Emery 1203
  • Emfac 1202
  • Hexacid C-9
  • N-PELARGONIC ACID
  • NSC 62787
  • Nonoic acid
  • Pelargic acid
  • Pelargon
  • n-Nonanoic acid
  • n-Nonoic acid
  • n-Nonylic acid
  • nonylic acid
  • pelargonic acid
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Physical Properties

Property Value Unit Source
ω 0.7603 PSRK revision IV (2005), critical constants and acentric factors of 1000 components Compiled value
ΔcH°liquid [-5456.10; -5452.25] kJ/mol Show Hide
ΔcH°liquid -5456.10 ± 0.90 kJ/mol NIST
ΔcH°liquid -5452.25 ± 0.96 kJ/mol NIST
ΔfG° -319.01 kJ/mol Joback Calculated Property
ΔfH°gas [-579.50; -575.60] kJ/mol Show Hide
ΔfH°gas -575.60 ± 1.00 kJ/mol NIST
ΔfH°gas -579.50 ± 1.00 kJ/mol NIST
ΔfH°gas -579.50 ± 1.00 kJ/mol NIST
ΔfH°liquid [-661.91; -658.00] kJ/mol Show Hide
ΔfH°liquid -658.00 ± 0.90 kJ/mol NIST
ΔfH°liquid -661.91 ± 0.96 kJ/mol NIST
ΔfusH° 29.21 kJ/mol Joback Calculated Property
ΔvapH° [82.40; 82.40] kJ/mol Show Hide
ΔvapH° 82.40 ± 0.40 kJ/mol NIST
ΔvapH° 82.40 ± 0.40 kJ/mol NIST
IE 9.99 eV Relay (1.0) Calculated Property
log10WS -2.75 Aq. Solubility Prediction
logPoct/wat 2.822 Crippen Calculated Property
McVol 145.110 ml/mol McGowan Calculated Property
Pc [2346.36; 2350.74] kPa Show Hide
Pc 2350.00 kPa IUPAC Vapor-Liquid Critical Properties of Elements and Compounds, part 7 Compiled value
Pc 2350.74 kPa PSRK revision IV (2005), critical constants and acentric factors of 1000 components Compiled value
Pc 2350.00 ± 200.00 kPa NIST
Pc 2346.36 ± 90.00 kPa NIST
Inp [214.30; 1319.00]   Show Hide
Inp 1283.00 NIST
Inp 1288.00 NIST
Inp 1260.00 NIST
Inp 1272.00 NIST
Inp 1295.00 NIST
Inp 1300.00 NIST
Inp 1302.00 NIST
Inp 1302.00 NIST
Inp 1303.00 NIST
Inp 1297.00 NIST
Inp 1278.00 NIST
Inp 1280.00 NIST
Inp 1272.00 NIST
Inp 1272.10 NIST
Inp 1268.00 NIST
Inp 1307.00 NIST
Inp 1290.00 NIST
Inp 1263.00 NIST
Inp 1263.00 NIST
Inp 1293.00 NIST
Inp 1277.00 NIST
Inp 1240.00 NIST
Inp 1280.00 NIST
Inp 1273.00 NIST
Inp 1280.00 NIST
Inp 1280.00 NIST
Inp 1281.00 NIST
Inp 1276.00 NIST
Inp 1280.00 NIST
Inp 1283.00 NIST
Inp 1260.00 NIST
Inp 1275.00 NIST
Inp 1269.00 NIST
Inp 1267.00 NIST
Inp 1276.00 NIST
Inp 1280.00 NIST
Inp 1256.00 NIST
Inp 1256.00 NIST
Inp 1280.00 NIST
Inp 1280.00 NIST
Inp 1283.00 NIST
Inp 1272.00 NIST
Inp 1273.00 NIST
Inp 1255.00 NIST
Inp 1263.00 NIST
Inp 1272.00 NIST
Inp 1273.00 NIST
Inp 1273.00 NIST
Inp 1273.00 NIST
Inp 1271.00 NIST
Inp 1275.00 NIST
Inp 1264.00 NIST
Inp 1271.00 NIST
Inp 1271.00 NIST
Inp 1280.00 NIST
Inp 1278.00 NIST
Inp 1269.00 NIST
Inp 1260.00 NIST
Inp 1261.00 NIST
Inp 1260.00 NIST
Inp 1256.00 NIST
Inp 1274.00 NIST
Inp 1280.00 NIST
Inp 1260.00 NIST
Inp 1308.00 NIST
Inp 1272.00 NIST
Inp 1272.00 NIST
Inp 1272.00 NIST
Inp 1273.00 NIST
Inp 1273.00 NIST
Inp 1277.00 NIST
Inp 1275.00 NIST
Inp 1237.00 NIST
Inp 1283.00 NIST
Inp 1275.00 NIST
Inp 1275.00 NIST
Inp 1280.00 NIST
Inp 1319.00 NIST
Inp 1278.00 NIST
Inp 1278.00 NIST
Inp 1282.00 NIST
Inp 1275.00 NIST
Inp 1280.00 NIST
Inp 1260.00 NIST
Inp 1288.00 NIST
Inp 1260.00 NIST
Inp 1273.00 NIST
Inp 1275.00 NIST
Inp 1272.00 NIST
Inp 1267.00 NIST
Inp 1269.00 NIST
Inp 1279.00 NIST
Inp 1280.00 NIST
Inp 1262.00 NIST
Inp 1248.00 NIST
Inp 1270.00 NIST
Inp 1262.00 NIST
Inp 1263.00 NIST
Inp 1271.00 NIST
Inp 1267.00 NIST
Inp 1270.00 NIST
Inp 1244.00 NIST
Inp 1278.00 NIST
Inp 1275.00 NIST
Inp 1226.00 NIST
Inp 1267.00 NIST
Inp 1266.00 NIST
Inp 1282.00 NIST
Inp 1279.00 NIST
Inp 1247.00 NIST
Inp 1239.00 NIST
Inp 1249.00 NIST
Inp 1271.00 NIST
Inp 1271.00 NIST
Inp 1308.00 NIST
Inp 1265.00 NIST
Inp 1275.00 NIST
Inp 1297.00 NIST
Inp 1265.00 NIST
Inp 1241.00 NIST
Inp 1280.00 NIST
Inp 1264.00 NIST
Inp 1264.00 NIST
Inp 1300.00 NIST
Inp 1265.00 NIST
Inp 1253.00 NIST
Inp 1270.00 NIST
Inp 1243.00 NIST
Inp 1279.00 NIST
Inp 1279.00 NIST
Inp 1285.00 NIST
Inp 1267.00 NIST
Inp 1276.00 NIST
Inp Outlier 217.59 NIST
Inp Outlier 214.30 NIST
Inp 1288.00 NIST
Inp 1302.00 NIST
Inp 1297.00 NIST
Inp Outlier 217.59 NIST
Inp 1280.00 NIST
Inp 1290.00 NIST
Inp 1240.00 NIST
Inp 1281.00 NIST
Inp 1275.00 NIST
Ip [2119.00; 2211.00]   Show Hide
Ip 2169.00 NIST
Ip 2171.00 NIST
Ip 2174.00 NIST
Ip 2174.00 NIST
Ip 2180.00 NIST
Ip 2144.00 NIST
Ip 2159.00 NIST
Ip 2193.00 NIST
Ip 2127.00 NIST
Ip 2173.00 NIST
Ip 2162.00 NIST
Ip 2124.00 NIST
Ip 2179.00 NIST
Ip 2144.00 NIST
Ip 2202.00 NIST
Ip 2173.00 NIST
Ip 2180.00 NIST
Ip 2149.00 NIST
Ip 2174.00 NIST
Ip 2135.00 NIST
Ip 2124.00 NIST
Ip 2194.00 NIST
Ip 2178.00 NIST
Ip 2181.00 NIST
Ip 2211.00 NIST
Ip 2166.00 NIST
Ip 2178.00 NIST
Ip 2181.00 NIST
Ip 2164.00 NIST
Ip 2164.00 NIST
Ip 2176.00 NIST
Ip 2128.00 NIST
Ip 2157.00 NIST
Ip 2157.00 NIST
Ip 2177.00 NIST
Ip 2132.00 NIST
Ip 2158.00 NIST
Ip 2158.00 NIST
Ip 2164.00 NIST
Ip 2157.00 NIST
Ip 2147.00 NIST
Ip 2130.00 NIST
Ip 2145.00 NIST
Ip Outlier 2119.00 NIST
Ip 2174.00 NIST
Ip 2178.00 NIST
Ip 2152.00 NIST
Ip 2163.00 NIST
Ip 2173.00 NIST
Ip 2146.00 NIST
Ip 2181.00 NIST
Ip 2168.00 NIST
Ip 2168.00 NIST
Ip 2168.00 NIST
Ip 2153.00 NIST
Ip 2169.00 NIST
Ip 2170.00 NIST
Ip 2176.00 NIST
Ip 2180.00 NIST
Ip 2182.00 NIST
Ip 2198.00 NIST
Ip 2210.00 NIST
Ip 2176.00 NIST
Ip 2196.00 NIST
Ip 2211.00 NIST
Ip 2173.00 NIST
Ip 2165.00 NIST
Ip 2150.00 NIST
Ip 2192.00 NIST
Ip 2172.00 NIST
Ip 2173.00 NIST
Ip 2196.00 NIST
Ip 2155.00 NIST
Ip 2165.00 NIST
Ip 2149.00 NIST
Ip 2175.00 NIST
Ip 2167.00 NIST
Ip 2124.00 NIST
Ip 2153.00 NIST
Ip 2137.00 NIST
Ip 2130.00 NIST
Ip 2192.00 NIST
Ip 2192.00 NIST
Ip 2192.00 NIST
Ip 2192.00 NIST
Ip 2192.00 NIST
Ip 2165.00 NIST
Ip 2127.00 NIST
Ip 2180.00 NIST
Ip 2123.00 NIST
Ip 2127.00 NIST
Ip 2194.00 NIST
Ip 2131.00 NIST
Ip 2140.00 NIST
Ip 2200.00 NIST
Ip 2150.00 NIST
Ip 2192.00 NIST
Ip 2184.00 NIST
Ip 2168.00 NIST
Ip 2170.00 NIST
Ip 2157.00 NIST
Ip 2157.00 NIST
Ip 2190.00 NIST
Ip 2176.00 NIST
Ip 2138.00 NIST
Ip 2192.00 NIST
Ip 2165.00 NIST
Ip 2162.00 NIST
Ip 2186.00 NIST
Ip 2192.00 NIST
Ip 2173.00 NIST
Ip 2177.00 NIST
Ip 2192.00 NIST
Ip 2176.00 NIST
Ip 2138.00 NIST
Ip 2138.00 NIST
Ip 2192.00 NIST
Ip 2192.00 NIST
Ip 2124.00 NIST
Ip 2128.00 NIST
Ip 2192.00 NIST
Ip 2192.00 NIST
Ip 2192.00 NIST
Ip 2134.00 NIST
Ip 2173.00 NIST
Ip 2192.00 NIST
Ip 2192.00 NIST
Ip 2192.00 NIST
Ip 2192.00 NIST
Ip 2192.00 NIST
Ip 2192.00 NIST
Ip 2192.00 NIST
Ip 2192.00 NIST
Ip 2175.00 NIST
Ip 2161.00 NIST
Ip 2132.00 NIST
Ip 2188.00 NIST
Ip 2132.00 NIST
Ip 2182.00 NIST
Ip 2174.00 NIST
Ip 2193.00 NIST
Ip 2179.00 NIST
Ip 2149.00 NIST
Ip 2178.00 NIST
Ip 2181.00 NIST
Ip 2157.00 NIST
Ip 2150.00 NIST
Ip 2192.00 NIST
Ip 2173.00 NIST
Ip 2138.00 NIST
Ip 2132.00 NIST
Ip 2158.00 NIST
Ip 2130.00 NIST
Ip 2169.00 NIST
Tboil [521.65; 533.15] K Show Hide
Tboil 528.20 K NIST
Tboil 527.15 ± 3.00 K NIST
Tboil 527.15 ± 1.50 K NIST
Tboil 527.15 ± 2.00 K NIST
Tboil 528.40 ± 3.00 K NIST
Tboil 523.00 ± 5.00 K NIST
Tboil 527.55 ± 1.00 K NIST
Tboil 523.15 ± 3.00 K NIST
Tboil 527.15 ± 2.00 K NIST
Tboil 526.15 ± 3.00 K NIST
Tboil 523.15 ± 3.00 K NIST
Tboil 527.70 ± 3.00 K NIST
Tboil 521.65 ± 4.00 K NIST
Tboil 526.65 ± 3.00 K NIST
Tboil 522.15 ± 5.00 K NIST
Tboil Outlier 533.15 ± 6.00 K NIST
Tc [709.58; 712.00] K Show Hide
Tc 712.00 K IUPAC Vapor-Liquid Critical Properties of Elements and Compounds, part 7 Compiled value
Tc 712.00 K PSRK revision IV (2005), critical constants and acentric factors of 1000 components Compiled value
Tc 712.00 ± 3.00 K NIST
Tc 709.58 ± 3.00 K NIST
Tfus [283.75; 285.70] K Show Hide
Tfus 285.15 K Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) Compiled value
Tfus 284.58 K Aq. Solubility Prediction
Tfus 285.70 ± 0.05 K NIST
Tfus 285.00 ± 1.50 K NIST
Tfus Outlier 283.75 ± 1.50 K NIST
Tfus 285.50 ± 0.20 K NIST
Tfus 285.70 ± 2.00 K NIST
Tfus 285.70 ± 2.00 K NIST
Ttriple [285.53; 285.53] K Show Hide
Ttriple 285.53 ± 0.02 K NIST
Ttriple 285.53 ± 0.02 K NIST
Vc 0.594 m3/kmol PSRK revision IV (2005), critical constants and acentric factors of 1000 components Compiled value

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,liquid [333.90; 362.37] J/mol×K [298.15; 304.00] Show Hide
Cp,liquid 362.37 J/mol×K 298.15 NIST
Cp,liquid 333.90 J/mol×K 304.00 NIST
ΔfusH 20.31 kJ/mol 285.50 NIST
ΔvapH [64.20; 85.30] kJ/mol [302.50; 454.50] Show Hide
ΔvapH 85.30 ± 2.00 kJ/mol 302.50 NIST
ΔvapH 64.20 kJ/mol 435.00 NIST
ΔvapH 76.90 kJ/mol 454.50 NIST
ρl [798.00; 906.00] kg/m3 [290.30; 427.90] Show Hide
ρl 906.00 kg/m3 290.30 Density, Viscosity, and Thermal Conductivity of Eight Carboxylic Acids from (290.3 to 473.4) K
ρl 893.80 kg/m3 308.00 Density, Viscosity, and Thermal Conductivity of Eight Carboxylic Acids from (290.3 to 473.4) K
ρl 881.90 kg/m3 323.10 Density, Viscosity, and Thermal Conductivity of Eight Carboxylic Acids from (290.3 to 473.4) K
ρl 870.10 kg/m3 338.10 Density, Viscosity, and Thermal Conductivity of Eight Carboxylic Acids from (290.3 to 473.4) K
ρl 858.40 kg/m3 353.10 Density, Viscosity, and Thermal Conductivity of Eight Carboxylic Acids from (290.3 to 473.4) K
ρl 846.70 kg/m3 368.00 Density, Viscosity, and Thermal Conductivity of Eight Carboxylic Acids from (290.3 to 473.4) K
ρl 834.10 kg/m3 383.10 Density, Viscosity, and Thermal Conductivity of Eight Carboxylic Acids from (290.3 to 473.4) K
ρl 822.30 kg/m3 398.10 Density, Viscosity, and Thermal Conductivity of Eight Carboxylic Acids from (290.3 to 473.4) K
ρl 810.30 kg/m3 413.00 Density, Viscosity, and Thermal Conductivity of Eight Carboxylic Acids from (290.3 to 473.4) K
ρl 798.00 kg/m3 427.90 Density, Viscosity, and Thermal Conductivity of Eight Carboxylic Acids from (290.3 to 473.4) K

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [210.03; 494.43] 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-6.93000e-01
Coefficient B9.09620e-01
Coefficient C-5.38400e-04
Coefficient D1.23900e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 210.03 J/mol×K 273.00 Calculated Property
Cp,gas 259.21 J/mol×K 353.78 Calculated Property
Cp,gas 303.08 J/mol×K 434.56 Calculated Property
Cp,gas 342.04 J/mol×K 515.33 Calculated Property
Cp,gas 376.47 J/mol×K 596.11 Calculated Property
Cp,gas 406.76 J/mol×K 676.89 Calculated Property
Cp,gas 433.31 J/mol×K 757.67 Calculated Property
Cp,gas 456.51 J/mol×K 838.44 Calculated Property
Cp,gas 476.75 J/mol×K 919.22 Calculated Property
Cp,gas 494.43 J/mol×K 1000.00 Calculated Property
Property Value Unit Temperature (K) Source
η [0.0062511; 0.0003496] Pa×s [285.33; 497.98] 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-1.18279e+01
Coefficient B1.92682e+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.285.33
Temperature range, max.497.98
η 0.0062511 Pa×s 285.33 Calculated Property
η 0.0037298 Pa×s 308.96 Calculated Property
η 0.0023948 Pa×s 332.59 Calculated Property
η 0.0016307 Pa×s 356.21 Calculated Property
η 0.0011648 Pa×s 379.84 Calculated Property
η 0.0008655 Pa×s 403.47 Calculated Property
η 0.0006645 Pa×s 427.10 Calculated Property
η 0.0005246 Pa×s 450.72 Calculated Property
η 0.0004240 Pa×s 474.35 Calculated Property
η 0.0003496 Pa×s 497.98 Calculated Property
Property Value Unit Temperature (K) Source
Pvap [1.33; 202.64] kPa [409.25; 555.23] The Yaws Handbook of Vapor Pressure Show Hide
Equationln(Y) = A + B/(T + C)
Y is Pvap in kPa, T in K
Coefficient A1.56017e+01
Coefficient B-4.57898e+03
Coefficient C-1.10247e+02
Temperature range, min.409.25
Temperature range, max.555.23
Pvap 1.33 kPa 409.25 Calculated Property
Pvap 2.93 kPa 425.47 Calculated Property
Pvap 5.97 kPa 441.69 Calculated Property
Pvap 11.37 kPa 457.91 Calculated Property
Pvap 20.45 kPa 474.13 Calculated Property
Pvap 34.99 kPa 490.35 Calculated Property
Pvap 57.28 kPa 506.57 Calculated Property
Pvap 90.22 kPa 522.79 Calculated Property
Pvap 137.30 kPa 539.01 Calculated Property
Pvap 202.64 kPa 555.23 Calculated Property
Pvap [3.06e-05; 2443.01] kPa [285.55; 703.00] 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 A2.17697e+02
Coefficient B-1.88791e+04
Coefficient C-2.88174e+01
Coefficient D1.18731e-05
Coefficient E0.00000e+00
Temperature range, min.285.55
Temperature range, max.703.00
Pvap 3.06e-05 kPa 285.55 Calculated Property
Pvap 5.77e-03 kPa 331.93 Calculated Property
Pvap 0.21 kPa 378.32 Calculated Property
Pvap 2.72 kPa 424.70 Calculated Property
Pvap 17.88 kPa 471.08 Calculated Property
Pvap 74.73 kPa 517.47 Calculated Property
Pvap 229.70 kPa 563.85 Calculated Property
Pvap 572.61 kPa 610.23 Calculated Property
Pvap 1239.13 kPa 656.62 Calculated Property
Pvap 2443.01 kPa 703.00 Calculated Property
Pvap [1.32; 8.80] kPa [410.00; 450.00] NIST Show Hide
Equationln(Y) = A + B/(T + C)
Y is Pvap in kPa, T in K
Coefficient A1.04689e+01
Coefficient B-1.78127e+03
Coefficient C-2.35239e+02
ReferenceKahlbaum, 1894
CommentCoefficents calculated by NIST from author's data.
Temperature range, min.410.00
Temperature range, max.450.00
Pvap 1.32 kPa 410.00 Calculated Property
Pvap 1.70 kPa 414.44 Calculated Property
Pvap 2.16 kPa 418.89 Calculated Property
Pvap 2.72 kPa 423.33 Calculated Property
Pvap 3.38 kPa 427.78 Calculated Property
Pvap 4.16 kPa 432.22 Calculated Property
Pvap 5.08 kPa 436.67 Calculated Property
Pvap 6.15 kPa 441.11 Calculated Property
Pvap 7.39 kPa 445.56 Calculated Property
Pvap 8.80 kPa 450.00 Calculated Property

Similar Compounds

Tricosanoic acid. n-Decanoic acid. Undecanoic acid. Tetradecanoic acid. N-TRIDECANOIC ACID. Octanoic acid. Tetracosanoic acid. Octadecanoic acid. Nonadecanoic acid. Eicosanoic acid. OCTACOSANOIC ACID. Dodecanoic acid. n-Hexadecanoic acid. Melissic acid. Hexacosanoic acid.

Find more compounds similar to Nonanoic acid.

Mixtures

Sources

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