Chemical Properties of Propanoic acid, phenyl ester (CAS 637-27-4)

Propanoic acid, phenyl ester

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InChI
InChI=1S/C9H10O2/c1-2-9(10)11-8-6-4-3-5-7-8/h3-7H,2H2,1H3
InChI Key
DYUMLJSJISTVPV-UHFFFAOYSA-N
Formula
C9H10O2
SMILES
CCC(=O)Oc1ccccc1
Molecular Weight1
150.17
CAS
637-27-4
Other Names
  • Phenyl propanoate
  • Phenyl propionate
  • Propionic acid, phenyl ester
Sources

Physical Properties

Property Value Unit Source
Δf -96.61 kJ/mol Joback Calculated Property
Δfgas -237.36 kJ/mol Joback Calculated Property
Δfus 15.89 kJ/mol Joback Calculated Property
Δvap 47.06 kJ/mol Joback Calculated Property
logPoct/wat 2.00 Crippen Calculated Property
Pc 3439.94 kPa Joback Calculated Property
Tboil 485.15 ± 1.00 K NIST
Tc 724.46 K Joback Calculated Property
Tfus 292.70 ± 1.00 K NIST
Vc 0.46 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 256.39 J/mol×K 508.29 Joback Calculated Property
η 0.00 Pa×s 508.29 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

Butanoic acid, phenyl ester. Propanoic acid, 4-methoxyphenyl ester. Phenyl isobutyrate. Phenyl .beta.-chloropropionate. Pentanoic acid, phenyl ester. Acetic acid, phenyl ester. Butyric acid, p-methoxyphenyl ester. 4-Chlorobutyric acid, phenyl ester. 2-Methylpropionic acid, 4-methoxyphenyl ester. Hexanoic acid, phenyl ester. Diphenyl succinate. Succinic acid, diphenyl ester. Adipic acid, diphenyl ester. Heptanoic acid, phenyl ester. 2-Chloropropionic acid, phenyl ester.

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