Chemical Properties of Hexanoic acid, 2-phenylethyl ester (CAS 6290-37-5)

Hexanoic acid, 2-phenylethyl ester

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InChI
InChI=1S/C14H20O2/c1-2-3-5-10-14(15)16-12-11-13-8-6-4-7-9-13/h4,6-9H,2-3,5,10-12H2,1H3
InChI Key
BUYNWUMUDHPPDS-UHFFFAOYSA-N
Formula
C14H20O2
SMILES
CCCCCC(=O)OCCc1ccccc1
Molecular Weight1
220.31
CAS
6290-37-5
Other Names
  • 2-Phenethyl hexanoate
  • 2-phenylethyl caproate
  • 2-phenylethyl hexanoate
  • Hexanoic acid, phenethyl ester
  • NSC 6651
  • Phenylethyl caproate
  • Phenylethyl hexanoate
  • Phenylethyl n-hexanoate
  • phenethyl hexanoate
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Physical Properties

Property Value Unit Source
Δf -54.51 kJ/mol Joback Calculated Property
Δfgas -340.56 kJ/mol Joback Calculated Property
Δfus 28.84 kJ/mol Joback Calculated Property
Δvap 58.19 kJ/mol Joback Calculated Property
log10WS -3.65 Crippen Calculated Property
logPoct/wat 3.353 Crippen Calculated Property
McVol 191.800 ml/mol McGowan Calculated Property
Pc 2094.58 kPa Joback Calculated Property
Inp [1606.00; 1660.00]   Show Hide
Inp 1650.00 NIST
Inp 1645.60 NIST
Inp 1639.00 NIST
Inp 1606.00 NIST
Inp 1649.00 NIST
Inp 1643.00 NIST
Inp 1616.00 NIST
Inp 1613.00 NIST
Inp 1619.00 NIST
Inp 1650.00 NIST
Inp 1650.00 NIST
Inp 1642.00 NIST
Inp 1660.00 NIST
Inp 1657.00 NIST
Inp 1650.00 NIST
Inp 1618.00 NIST
Inp 1618.00 NIST
Inp 1650.00 NIST
I [2134.00; 2178.00]   Show Hide
I 2136.00 NIST
I 2164.00 NIST
I 2166.00 NIST
I 2160.00 NIST
I 2160.00 NIST
I 2165.00 NIST
I 2165.00 NIST
I 2178.00 NIST
I 2134.00 NIST
I 2134.00 NIST
Tboil 622.69 K Joback Calculated Property
Tc 822.76 K Joback Calculated Property
Tfus 346.12 K Joback Calculated Property
Vc 0.736 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [494.13; 579.01] J/mol×K [622.69; 822.76] Show Hide
Cp,gas 494.13 J/mol×K 622.69 Joback Calculated Property
Cp,gas 510.47 J/mol×K 656.04 Joback Calculated Property
Cp,gas 525.89 J/mol×K 689.38 Joback Calculated Property
Cp,gas 540.43 J/mol×K 722.73 Joback Calculated Property
Cp,gas 554.11 J/mol×K 756.07 Joback Calculated Property
Cp,gas 566.96 J/mol×K 789.42 Joback Calculated Property
Cp,gas 579.01 J/mol×K 822.76 Joback Calculated Property
η [0.0001517; 0.0020543] Pa×s [346.12; 622.69] Show Hide
η 0.0020543 Pa×s 346.12 Joback Calculated Property
η 0.0010310 Pa×s 392.21 Joback Calculated Property
η 0.0005982 Pa×s 438.31 Joback Calculated Property
η 0.0003849 Pa×s 484.40 Joback Calculated Property
η 0.0002674 Pa×s 530.50 Joback Calculated Property
η 0.0001969 Pa×s 576.60 Joback Calculated Property
η 0.0001517 Pa×s 622.69 Joback Calculated Property
ΔvapH 78.80 kJ/mol 298.15 Vapor p...

Similar Compounds

Heptanoic acid, 2-phenylethyl ester. Decanoic acid, 2-phenylethyl ester. 2-Phenylethyl docosanoate. Phenethyl palmitate. Nonanoic acid, 2-phenylethyl ester. Dodecanoic acid, 2-phenylethyl ester. Phenethyl icosanoate. Phenethyl stearate. Octanoic acid, 2-phenylethyl ester. Phenethyl tetradecanoate. Pimelic acid, di(phenethyl) ester. Pentanoic acid, 2-phenylethyl ester. Pimelic acid, ethyl phenethyl ester. Pimelic acid, phenethyl propyl ester. Pimelic acid, butyl phenethyl ester.

Find more compounds similar to Hexanoic acid, 2-phenylethyl ester.

Sources

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