Chemical Properties of Hexanoic acid, 4-methyl- (CAS 1561-11-1)

Hexanoic acid, 4-methyl-

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InChI
InChI=1S/C7H14O2/c1-3-6(2)4-5-7(8)9/h6H,3-5H2,1-2H3,(H,8,9)
InChI Key
DIVCBWJKVSFZKJ-UHFFFAOYSA-N
Formula
C7H14O2
SMILES
CCC(C)CCC(=O)O
Molecular Weight1
130.18
CAS
1561-11-1
Other Names
  • 4-Methylhexanoic acid
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Physical Properties

Property Value Unit Source
Δf -260.12 kJ/mol Joback Calculated Property
Δfgas -457.90 kJ/mol Joback Calculated Property
Δfus 16.05 kJ/mol Joback Calculated Property
Δvap 54.21 kJ/mol Joback Calculated Property
log10WS -1.61 Crippen Calculated Property
logPoct/wat 1.897 Crippen Calculated Property
McVol 116.930 ml/mol McGowan Calculated Property
Pc 3352.86 kPa Joback Calculated Property
I [1921.00; 1936.00]   Show Hide
I 1936.00 NIST
I 1921.00 NIST
I 1936.00 NIST
Tboil 505.17 K Joback Calculated Property
Tc 678.63 K Joback Calculated Property
Tfus 264.40 K Joback Calculated Property
Vc 0.447 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [265.80; 320.81] J/mol×K [505.17; 678.63] Show Hide
Cp,gas 265.80 J/mol×K 505.17 Joback Calculated Property
Cp,gas 276.01 J/mol×K 534.08 Joback Calculated Property
Cp,gas 285.78 J/mol×K 562.99 Joback Calculated Property
Cp,gas 295.14 J/mol×K 591.90 Joback Calculated Property
Cp,gas 304.09 J/mol×K 620.81 Joback Calculated Property
Cp,gas 312.64 J/mol×K 649.72 Joback Calculated Property
Cp,gas 320.81 J/mol×K 678.63 Joback Calculated Property
η [0.0001662; 0.0353274] Pa×s [264.40; 505.17] Show Hide
η 0.0353274 Pa×s 264.40 Joback Calculated Property
η 0.0080276 Pa×s 304.53 Joback Calculated Property
η 0.0025758 Pa×s 344.66 Joback Calculated Property
η 0.0010476 Pa×s 384.78 Joback Calculated Property
η 0.0005050 Pa×s 424.91 Joback Calculated Property
η 0.0002761 Pa×s 465.04 Joback Calculated Property
η 0.0001662 Pa×s 505.17 Joback Calculated Property

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.67] kPa [374.52; 508.51] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.64465e+01
Coefficient B-4.79870e+03
Coefficient C-7.75510e+01
Temperature range, min.374.52
Temperature range, max.508.51
Pvap 1.33 kPa 374.52 Calculated Property
Pvap 2.88 kPa 389.41 Calculated Property
Pvap 5.81 kPa 404.30 Calculated Property
Pvap 11.02 kPa 419.18 Calculated Property
Pvap 19.82 kPa 434.07 Calculated Property
Pvap 33.99 kPa 448.96 Calculated Property
Pvap 55.93 kPa 463.85 Calculated Property
Pvap 88.69 kPa 478.73 Calculated Property
Pvap 136.07 kPa 493.62 Calculated Property
Pvap 202.67 kPa 508.51 Calculated Property

Similar Compounds

4-Methyloctanoic acid. 4-Ethyloctanoic acid. Cyclopentanepropanoic acid. Cyclohexanepropanoic acid. Pentanoic acid, 4-methyl-. 5-methylhexanoic acid. 11-methyldodecanoic acid. 14-methylpentadecanoic acid. isopentadecanoic acid. Tridecanoic acid, 12-methyl. 13-methyltetradecanoic acid. 15-methylhexadecanoic acid. Isoundecanoic acid. (R)-(+)-3-Methyladipic acid. Cyclopentaneundecanoic acid.

Find more compounds similar to Hexanoic acid, 4-methyl-.

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