Chemical Properties of Butanoic acid, 2-methyl-, 2-phenylethyl ester (CAS 24817-51-4)

Butanoic acid, 2-methyl-, 2-phenylethyl ester

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InChI
InChI=1S/C13H18O2/c1-3-11(2)13(14)15-10-9-12-7-5-4-6-8-12/h4-8,11H,3,9-10H2,1-2H3
InChI Key
KVKKTLBBYFABAZ-UHFFFAOYSA-N
Formula
C13H18O2
SMILES
CCC(C)C(=O)OCCc1ccccc1
Molecular Weight1
206.28
CAS
24817-51-4
Other Names
  • Phenethyl 2-methylbutyrate
  • 2-Phenylethyl 2-methylbutanoate
  • 2-Phenylethyl 2-methylbutyrate
  • Phenethyl 2-methylbutanoate
  • Phenylethyl 2-methylbutanoate
  • FEMA 3632
  • «beta»-Phenethyl «alpha»-methylbutanoate
  • Butyric acid, 2-methyl-, phenethyl ester
  • Phenylethyl 2-methylbutyrate
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Physical Properties

Property Value Unit Source
Δf -65.37 kJ/mol Joback Calculated Property
Δfgas -325.20 kJ/mol Joback Calculated Property
Δfus 22.73 kJ/mol Joback Calculated Property
Δvap 55.58 kJ/mol Joback Calculated Property
log10WS -2.99 Crippen Calculated Property
logPoct/wat 2.818 Crippen Calculated Property
McVol 177.710 ml/mol McGowan Calculated Property
Pc 2309.17 kPa Joback Calculated Property
Inp [1460.00; 1491.30]   Show Hide
Inp 1484.00 NIST
Inp 1460.00 NIST
Inp 1488.00 NIST
Inp 1491.00 NIST
Inp 1466.00 NIST
Inp 1491.30 NIST
Inp 1487.00 NIST
Inp 1472.00 NIST
I [1945.00; 1988.00]   Show Hide
I 1950.00 NIST
I 1964.00 NIST
I 1988.00 NIST
I 1968.00 NIST
I 1988.00 NIST
I 1988.00 NIST
I 1988.00 NIST
I 1945.00 NIST
I 1988.00 NIST
I 1964.00 NIST
I 1950.00 NIST
Tboil 599.37 K Joback Calculated Property
Tc 806.35 K Joback Calculated Property
Tfus 319.85 K Joback Calculated Property
Vc 0.673 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [443.71; 527.37] J/mol×K [599.37; 806.35] Show Hide
Cp,gas 443.71 J/mol×K 599.37 Joback Calculated Property
Cp,gas 459.89 J/mol×K 633.87 Joback Calculated Property
Cp,gas 475.13 J/mol×K 668.36 Joback Calculated Property
Cp,gas 489.48 J/mol×K 702.86 Joback Calculated Property
Cp,gas 502.95 J/mol×K 737.36 Joback Calculated Property
Cp,gas 515.57 J/mol×K 771.85 Joback Calculated Property
Cp,gas 527.37 J/mol×K 806.35 Joback Calculated Property
η [0.0001567; 0.0027865] Pa×s [319.85; 599.37] Show Hide
η 0.0027865 Pa×s 319.85 Joback Calculated Property
η 0.0012714 Pa×s 366.44 Joback Calculated Property
η 0.0006925 Pa×s 413.02 Joback Calculated Property
η 0.0004266 Pa×s 459.61 Joback Calculated Property
η 0.0002873 Pa×s 506.20 Joback Calculated Property
η 0.0002068 Pa×s 552.78 Joback Calculated Property
η 0.0001567 Pa×s 599.37 Joback Calculated Property

Similar Compounds

2-Ethylbutyric acid, phenethyl ester. Butanoic acid, 3-methyl-, 2-phenylethyl ester. «beta»-Phenylethyl butyrate. Propanoic acid, 2-methyl-, 2-phenylethyl ester. Hexanoic acid, 2-phenylethyl ester. Heptanoic acid, 2-phenylethyl ester. Pentanoic acid, 2-phenylethyl ester. Dodecanoic acid, 2-phenylethyl ester. Phenethyl icosanoate. Nonanoic acid, 2-phenylethyl ester. Phenethyl tetradecanoate. Phenethyl stearate. Decanoic acid, 2-phenylethyl ester. Octanoic acid, 2-phenylethyl ester. 2-Phenylethyl docosanoate.

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

Sources

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