Chemical Properties of 5-Bromovaleric acid, pentadecyl ester

5-Bromovaleric acid, pentadecyl ester

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InChI
InChI=1S/C20H39BrO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-19-23-20(22)17-14-15-18-21/h2-19H2,1H3
InChI Key
XUJOLDAHEPWFMY-UHFFFAOYSA-N
Formula
C20H39BrO2
SMILES
CCCCCCCCCCCCCCCOC(=O)CCCCBr
Molecular Weight1
391.43
Sources

Physical Properties

Property Value Unit Source
Δf -102.08 kJ/mol Joback Calculated Property
Δfgas -674.60 kJ/mol Joback Calculated Property
Δfus 55.63 kJ/mol Joback Calculated Property
Δvap 75.70 kJ/mol Joback Calculated Property
logPoct/wat 7.19 Crippen Calculated Property
Pc 1094.27 kPa Joback Calculated Property
Tboil 799.45 K Joback Calculated Property
Tc 983.10 K Joback Calculated Property
Tfus 447.12 K Joback Calculated Property
Vc 1.24 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 963.19 J/mol×K 799.45 Joback Calculated Property
η 0.00 Pa×s 799.45 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-CH2- 18
-CH3 1
-Br 1
>C=O (nonring) 1

Similar Compounds

5-Bromovaleric acid, octadecyl ester. 5-Bromovaleric acid, heptadecyl ester. 5-Bromovaleric acid, octyl ester. 5-Bromovaleric acid, tetradecyl ester. 5-Bromovaleric acid, tridecyl ester. 5-Bromovaleric acid, hexadecyl ester. 5-Bromovaleric acid, decyl ester. 5-Bromovaleric acid, heptyl ester. 5-Bromovaleric acid, pentyl ester. Valeric acid, dodecyl ester. Pentanoic acid, nonyl ester. Pentanoic acid, undecyl ester. Valeric acid, hexadecyl ester. Valeric acid, tetradecyl ester. Valeric acid, tridecyl ester.

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