Chemical Properties of Sebacic acid, 4-bromophenyl propyl ester

Sebacic acid, 4-bromophenyl propyl ester

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InChI
InChI=1S/C19H27BrO4/c1-2-15-23-18(21)9-7-5-3-4-6-8-10-19(22)24-17-13-11-16(20)12-14-17/h11-14H,2-10,15H2,1H3
InChI Key
PYIZYASZOZGAKK-UHFFFAOYSA-N
Formula
C19H27BrO4
SMILES
CCCOC(=O)CCCCCCCCC(=O)Oc1ccc(Br)cc1
Molecular Weight1
399.32
Sources

Physical Properties

Property Value Unit Source
Δf -241.64 kJ/mol Joback Calculated Property
Δfgas -673.70 kJ/mol Joback Calculated Property
Δfus 49.48 kJ/mol Joback Calculated Property
Δvap 85.57 kJ/mol Joback Calculated Property
logPoct/wat 5.43 Crippen Calculated Property
Pc 1519.94 kPa Joback Calculated Property
Tboil 884.52 K Joback Calculated Property
Tc 1095.03 K Joback Calculated Property
Tfus 546.95 K Joback Calculated Property
Vc 1.10 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 859.35 J/mol×K 884.52 Joback Calculated Property
η 0.00 Pa×s 884.52 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
>C=O (nonring) 2
=CH- (ring) 4
=C< (ring) 2
-CH2- 10
-CH3 1
-Br 1

Similar Compounds

Sebacic acid, 4-bromophenyl butyl ester. Sebacic acid, 4-bromophenyl octyl ester. Sebacic acid, 4-bromophenyl nonyl ester. Sebacic acid, 4-bromophenyl pentyl ester. Sebacic acid, 4-bromophenyl heptyl ester. Sebacic acid, 4-bromophenyl decyl ester. Sebacic acid, 4-bromophenyl ethyl ester. Sebacic acid, 4-bromophenyl isohexyl ester. Sebacic acid, 4-bromophenyl isobutyl ester. Glutaric acid, 4-bromophenyl heptyl ester. Glutaric acid, 4-bromophenyl octyl ester. Glutaric acid, 4-bromophenyl dodecyl ester. Glutaric acid, 4-bromophenyl tetradecyl ester. Glutaric acid, 4-bromophenyl nonyl ester. Glutaric acid, 4-bromophenyl pentadecyl ester.

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