Chemical Properties of 5-Bromovaleric acid, 2-pentadecyl ester

5-Bromovaleric acid, 2-pentadecyl ester

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InChI
InChI=1S/C20H39BrO2/c1-3-4-5-6-7-8-9-10-11-12-13-16-19(2)23-20(22)17-14-15-18-21/h19H,3-18H2,1-2H3
InChI Key
HSOKXQMYYGQAEY-UHFFFAOYSA-N
Formula
C20H39BrO2
SMILES
CCCCCCCCCCCCCC(C)OC(=O)CCCCBr
Molecular Weight1
391.43
Sources

Physical Properties

Property Value Unit Source
Δf -104.52 kJ/mol Joback Calculated Property
Δfgas -679.88 kJ/mol Joback Calculated Property
Δfus 52.11 kJ/mol Joback Calculated Property
Δvap 75.32 kJ/mol Joback Calculated Property
logPoct/wat 7.18 Crippen Calculated Property
Pc 1100.08 kPa Joback Calculated Property
Tboil 799.01 K Joback Calculated Property
Tc 983.68 K Joback Calculated Property
Tfus 432.12 K Joback Calculated Property
Vc 1.24 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 963.67 J/mol×K 799.01 Joback Calculated Property
η 0.00 Pa×s 799.01 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 1
-CH3 2
-CH2- 16
>C=O (nonring) 1
-Br 1

Similar Compounds

5-Bromovaleric acid, 2-tridecyl ester. 5-Bromovaleric acid, 2-tetradecyl ester. 5-Bromovaleric acid, 4-hexadecyl ester. 5-Bromovaleric acid, 3-tetradecyl ester. 5-Bromovaleric acid, 3-pentadecyl ester. 5-Bromovaleric acid, 4-tetradecyl ester. 5-Bromovaleric acid, 5-pentadecyl ester. 5-Bromovaleric acid, 4-pentadecyl ester. 5-Bromovaleric acid, 5-tridecyl ester. 5-Bromovaleric acid, 5-tetradecyl ester. 5-Bromovaleric acid, 4-tridecyl ester. 5-Bromovaleric acid, 3-tridecyl ester. Pentanoic acid, 2-octyl ester. 2-nonyl hexanoate. 2-Heptanol, pentanoate.

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