Chemical Properties of Phenylcarbamic acid butyl ester (CAS 1538-74-5)

Phenylcarbamic acid butyl ester

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InChI
InChI=1S/C11H15NO2/c1-2-3-9-14-11(13)12-10-7-5-4-6-8-10/h4-8H,2-3,9H2,1H3,(H,12,13)
InChI Key
ZTIMKJROOYMUMU-UHFFFAOYSA-N
Formula
C11H15NO2
SMILES
CCCCOC(=O)Nc1ccccc1
Molecular Weight1
193.24
CAS
1538-74-5
Other Names
  • Butyl N-phenylcarbamate
  • Butyl N-phenylurethane
  • Butyl carbanilate
  • Butylphenylurethane
  • Carbanilic acid, butyl ester
  • Carbanilic acid, n-butyl ester
  • Phenylcarbamic acid butyl ester
Sources

Physical Properties

Property Value Unit Source
Δcsolid -6077.00 ± 3.00 kJ/mol NIST
Δf 9.62 kJ/mol Joback Calculated Property
Δfgas -225.17 kJ/mol Joback Calculated Property
Δfus 26.17 kJ/mol Joback Calculated Property
Δvap 57.95 kJ/mol Joback Calculated Property
logPoct/wat 3.04 Crippen Calculated Property
Pc 2817.33 kPa Joback Calculated Property
Tboil 604.22 K Joback Calculated Property
Tc 813.47 K Joback Calculated Property
Tfus 364.97 K Joback Calculated Property
Vc 0.60 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 396.32 J/mol×K 604.22 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
>C=O (nonring) 1
=CH- (ring) 5
=C< (ring) 1
-CH2- 3
>NH 1
-CH3 1

Similar Compounds

Carbanilic acid, n-pentyl ester. Carbanilic acid, n-nonyl ester. Carbanilic acid, n-undecyl ester. Carbanilic acid, n-dodecyl ester. Ethyl N-phenylcarbamate. Carbamic acid, phenyl-, 1-methylethyl ester. Carbamic acid, 4-methylphenyl, heptyl ester. Tert-butyl carbanilate. Isobutylcarbamate, N-(4-methylphenyl). Carbamic acid, phenyl-, methyl ester. Carbamic acid, 4-methylphenyl, ethyl ester. P-methoxy carbanilic acid, n-butyl ester. Carbamic acid, 4-iodophenyl, ethyl ester. P-phenylazo carbanilic acid, n-butyl ester. Carbamic acid, 4-bromophenyl-, ethyl ester.

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