Chemical Properties of Butanoic acid, 2-methyl-, phenylmethyl ester (CAS 56423-40-6)

Butanoic acid, 2-methyl-, phenylmethyl ester

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InChI
InChI=1S/C12H16O2/c1-3-10(2)12(13)14-9-11-7-5-4-6-8-11/h4-8,10H,3,9H2,1-2H3
InChI Key
PTKDIBUNVYIPOD-UHFFFAOYSA-N
Formula
C12H16O2
SMILES
CCC(C)C(=O)OCc1ccccc1
Molecular Weight1
192.25
CAS
56423-40-6
Other Names
  • Benzyl 2-methylbutyrate
  • Benzyl 2-methylbutanoate
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Physical Properties

Property Value Unit Source
Δf -73.79 kJ/mol Joback Calculated Property
Δfgas -304.56 kJ/mol Joback Calculated Property
Δfus 20.14 kJ/mol Joback Calculated Property
Δvap 53.35 kJ/mol Joback Calculated Property
log10WS -3.06 Crippen Calculated Property
logPoct/wat 2.776 Crippen Calculated Property
McVol 163.620 ml/mol McGowan Calculated Property
Pc 2537.93 kPa Joback Calculated Property
Inp [1357.00; 1392.00]   Show Hide
Inp 1392.00 NIST
Inp 1357.00 NIST
Inp 1357.00 NIST
Inp 1392.00 NIST
I [1880.00; 1880.00]   Show Hide
I 1880.00 NIST
I 1880.00 NIST
I 1880.00 NIST
Tboil 576.49 K Joback Calculated Property
Tc 786.80 K Joback Calculated Property
Tfus 308.58 K Joback Calculated Property
Vc 0.618 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [394.41; 474.82] J/mol×K [576.49; 786.80] Show Hide
Cp,gas 394.41 J/mol×K 576.49 Joback Calculated Property
Cp,gas 409.96 J/mol×K 611.54 Joback Calculated Property
Cp,gas 424.63 J/mol×K 646.59 Joback Calculated Property
Cp,gas 438.42 J/mol×K 681.64 Joback Calculated Property
Cp,gas 451.37 J/mol×K 716.69 Joback Calculated Property
Cp,gas 463.49 J/mol×K 751.74 Joback Calculated Property
Cp,gas 474.82 J/mol×K 786.80 Joback Calculated Property
η [0.0001725; 0.0029260] Pa×s [308.58; 576.49] Show Hide
η 0.0029260 Pa×s 308.58 Joback Calculated Property
η 0.0013546 Pa×s 353.23 Joback Calculated Property
η 0.0007455 Pa×s 397.88 Joback Calculated Property
η 0.0004628 Pa×s 442.54 Joback Calculated Property
η 0.0003136 Pa×s 487.19 Joback Calculated Property
η 0.0002268 Pa×s 531.84 Joback Calculated Property
η 0.0001725 Pa×s 576.49 Joback Calculated Property

Similar Compounds

2-Ethylbutyric acid, 3-methylbenzyl ester. 2-Ethylbutyric acid, 2-naphthylmethyl ester. 2-Ethylbutyric acid, 3-chlorobenzyl ester. Butanoic acid, phenylmethyl ester. Butanoic acid, 3-methyl-, phenylmethyl ester. Hexanoic acid, phenylmethyl ester. Heptanoic acid, phenylmethyl ester. Octadecanoic acid, phenylmethyl ester. Dodecanoic acid, phenylmethyl ester. Octanoic acid, phenylmethyl ester. Eicosanoic acid, phenylmethyl ester. Heptadecanoic acid, phenylmethyl ester. Undecanoic acid, phenylmethyl ester. Nonanoic acid, phenylmethyl ester. benzyl docosanoate.

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

Sources

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