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

Benzeneacetic acid, 2-methylpropyl ester

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InChI Key
Molecular Weight1
Other Names
  • 2-Methylpropyl phenylacetate
  • Acetic acid, phenyl-, isobutyl ester
  • Iphaneine
  • Isobutyl phenylacetate
  • Isobutyl phenylethanoate
  • Isobutyl «alpha»-toluate
  • NSC 6602
  • Phenylacetic acid, 2-methylpropyl ester
  • Phenylacetic acid, isobutyl ester

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
logPoct/wat 2.428 Crippen Calculated Property
Pc 2537.93 kPa Joback Calculated Property
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/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 394.41 J/mol×K 576.49 Joback Calculated Property
η 0.0001723 Pa×s 576.49 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 1
>C=O (nonring) 1
=CH- (ring) 5
=C< (ring) 1
-CH2- 2
-CH3 2

Similar Compounds

Phenylacetic acid propyl ester. Phenylacetic acid, 2-methylbutyl ester. Benzeneacetic acid, butyl ester. Benzeneacetic acid, ethyl ester. Acetic acid, phenyl-, isopentyl ester. Pentyl phenylacetate. Benzeneacetic acid, hexyl ester. Acetic acid, phenyl-, 3-hexenyl ester. cis-3-Hexenyl phenyl acetate. Ethyl-p-tolylacetate. Benzeneacetic acid 1-methylethyl ester. Benzeneacetic acid, 2-propenyl ester. Benzeneacetic acid, heptyl ester. Benzeneacetic acid, octyl ester. Benzeneacetic acid, nonyl ester.

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