Chemical Properties of Benzoic acid, 4-methoxy-, phenyl ester (CAS 4181-97-9)

Benzoic acid, 4-methoxy-, phenyl ester

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InChI
InChI=1S/C14H12O3/c1-16-12-9-7-11(8-10-12)14(15)17-13-5-3-2-4-6-13/h2-10H,1H3
InChI Key
BNZYBNYNPXKWCM-UHFFFAOYSA-N
Formula
C14H12O3
SMILES
COc1ccc(C(=O)Oc2ccccc2)cc1
Molecular Weight1
228.24
CAS
4181-97-9
Other Names
  • p-Methoxybenzoic acid, phenyl ester
Sources

Physical Properties

Property Value Unit Source
Δf -56.73 kJ/mol Joback Calculated Property
Δfgas -247.72 kJ/mol Joback Calculated Property
Δfus 23.68 kJ/mol Joback Calculated Property
Δvap 63.54 kJ/mol Joback Calculated Property
logPoct/wat 2.91 Crippen Calculated Property
Pc 2811.36 kPa Joback Calculated Property
Tboil 676.77 K Joback Calculated Property
Tc 916.60 K Joback Calculated Property
Tfus 407.29 K Joback Calculated Property
Vc 0.65 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 440.07 J/mol×K 676.77 Joback Calculated Property
η 0.00 Pa×s 676.77 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
=C< (ring) 3
-CH3 1
>C=O (nonring) 1
=CH- (ring) 9

Similar Compounds

p-Anisic acid, 4-methoxyphenyl ester. Benzoic acid, 4-methylphenyl ester. P-anisic acid, 4-cyanophenyl ester. p-Anisic acid, 3-methylphenyl ester. Benzoic acid, phenyl ester. 4-Benzyloxybenzoic acid. p-Anisic acid, 2-naphthyl ester. 1,4-Benzenediol, monobenzoate. P-anisic acid, 3,5-dimethylphenyl ester. 4-Methoxyphenyl 4'-(3-butenyloxy)benzoate. p-Methoxybenzoic acid, 2-methylphenyl ester. Benzoic acid, 4-methyl-, phenyl ester. Diphenyl terephthalate. Benzoic acid, 4-isopropyl phenyl ester. 4-n-Hexoxyphenyl-4'-n-decyloxybenzoate.

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