Chemical Properties of N-butyl-o-benzoyl benzoate (CAS 571-98-2)

N-butyl-o-benzoyl benzoate

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InChI
InChI=1S/C18H18O3/c1-2-3-13-21-18(20)16-12-8-7-11-15(16)17(19)14-9-5-4-6-10-14/h4-12H,2-3,13H2,1H3
InChI Key
VMHKPGQWBDCKSM-UHFFFAOYSA-N
Formula
C18H18O3
SMILES
CCCCOC(=O)c1ccccc1C(=O)c1ccccc1
Molecular Weight1
282.33
CAS
571-98-2
Sources

Physical Properties

Property Value Unit Source
Δf -46.97 kJ/mol Joback Calculated Property
Δfgas -310.64 kJ/mol Joback Calculated Property
Δfus 34.45 kJ/mol Joback Calculated Property
Δvap 76.78 kJ/mol Joback Calculated Property
logPoct/wat 3.87 Crippen Calculated Property
Pc 2085.03 kPa Joback Calculated Property
Tboil 799.74 K Joback Calculated Property
Tc 1030.70 K Joback Calculated Property
Tfus 480.07 K Joback Calculated Property
Vc 0.86 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 641.46 J/mol×K 799.74 Joback Calculated Property
η 0.00 Pa×s 799.74 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
>C=O (nonring) 2
=CH- (ring) 9
=C< (ring) 3
-CH2- 3
-CH3 1

Similar Compounds

O-benzoylbenzoic acid, ethyl ester. O-benzoyl benzoic acid, 2-ethoxy-ethyl ether. Benzoic acid, 2-benzoyl-, methyl ester. Benzoic acid, 2-benzoyl-. Benzoic acid, 2-(4-methylbenzoyl)-. Norephedrine-o-(p-hydroxybenzoyl)benzoate. Benzoic acid, o-(2-hydroxybenzoyl)-. 2'-Carboxy-2-hydroxy-4-methoxybenzophenone. butyl 2-methylbutyl phthalate. 1,2-Benzenedicarboxylic acid, butyl 2-methylpropyl ester. 2-((2-Ethylbutoxy)carbonyl)benzoic acid. Phthalic acid, isobutyl pent-4-enyl ester. Phthalic acid, 2-ethylbutyl propyl ester. Phthalic acid, butyl 2-ethylbutyl ester. Phthalic acid, 2-ethylbutyl isobutyl ester.

Find more compounds similar to N-butyl-o-benzoyl benzoate.

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