Chemical Properties of Sebacic acid, 4-bromophenyl ethyl ester

Sebacic acid, 4-bromophenyl ethyl ester

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InChI
InChI=1S/C18H25BrO4/c1-2-22-17(20)9-7-5-3-4-6-8-10-18(21)23-16-13-11-15(19)12-14-16/h11-14H,2-10H2,1H3
InChI Key
OOMPMQHVZOPSCJ-UHFFFAOYSA-N
Formula
C18H25BrO4
SMILES
CCOC(=O)CCCCCCCCC(=O)Oc1ccc(Br)cc1
Molecular Weight1
385.29
Sources

Physical Properties

Property Value Unit Source
Δf -250.06 kJ/mol Joback Calculated Property
Δfgas -653.06 kJ/mol Joback Calculated Property
Δfus 46.89 kJ/mol Joback Calculated Property
Δvap 83.35 kJ/mol Joback Calculated Property
logPoct/wat 5.04 Crippen Calculated Property
Pc 1640.43 kPa Joback Calculated Property
Tboil 861.64 K Joback Calculated Property
Tc 1071.94 K Joback Calculated Property
Tfus 535.68 K Joback Calculated Property
Vc 1.05 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 801.28 J/mol×K 861.64 Joback Calculated Property
η 0.00 Pa×s 861.64 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
>C=O (nonring) 2
=CH- (ring) 4
=C< (ring) 2
-CH2- 9
-CH3 1
-Br 1

Similar Compounds

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

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