Chemical Properties of Benzeneacetic acid, 2-methylpropyl ester (CAS 102-13-6)

Benzeneacetic acid, 2-methylpropyl ester

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InChI
InChI=1S/C12H16O2/c1-10(2)9-14-12(13)8-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3
InChI Key
RJASFPFZACBKBE-UHFFFAOYSA-N
Formula
C12H16O2
SMILES
CC(C)COC(=O)Cc1ccccc1
Molecular Weight1
192.25
CAS
102-13-6
Other Names
  • Acetic acid, phenyl-, isobutyl ester
  • Isobutyl «alpha»-toluate
  • Isobutyl phenylacetate
  • Phenylacetic acid, isobutyl ester
  • Isobutyl phenylethanoate
  • Phenylacetic acid, 2-methylpropyl ester
  • 2-Methylpropyl phenylacetate
  • Iphaneine
  • NSC 6602
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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 -2.57 Crippen Calculated Property
logPoct/wat 2.428 Crippen Calculated Property
McVol 163.620 ml/mol McGowan Calculated Property
Pc 2537.93 kPa Joback Calculated Property
Inp [1371.00; 1392.00]   Show Hide
Inp 1371.00 NIST
Inp 1378.00 NIST
Inp 1392.00 NIST
Inp 1371.00 NIST
Inp 1392.00 NIST
I [1864.00; 1864.00]   Show Hide
I 1864.00 NIST
I 1864.00 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

Phenylacetic acid propyl ester. Phenylacetic acid, 2-methylbutyl ester. 1-Naphthaleneacetic acid, isobutyl ester. Benzeneacetic acid, butyl ester. Acetic acid, phenyl-, isopentyl ester. Phenylacetic acid, 4-chloro-, propyl ester. Pentyl phenylacetate. Benzeneacetic acid, hexyl ester. Benzeneacetic acid, heptyl ester. Benzeneacetic acid, nonyl ester. Benzeneacetic acid, decyl ester. Benzeneacetic acid, octyl ester. 1-Naphthaleneacetic acid, propyl ester. Benzeneacetic acid, ethyl ester. 2-Chloroethyl phenyl acetate.

Find more compounds similar to Benzeneacetic acid, 2-methylpropyl ester.

Sources

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