Chemical Properties of 2- Bromopropionic acid, pentyl ester (CAS 86711-73-1)

2- Bromopropionic acid, pentyl ester

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InChI
InChI=1S/C8H15BrO2/c1-3-4-5-6-11-8(10)7(2)9/h7H,3-6H2,1-2H3
InChI Key
IJSDPKDUSUXUFY-UHFFFAOYSA-N
Formula
C8H15BrO2
SMILES
CCCCCOC(=O)C(C)Br
Molecular Weight1
223.11
CAS
86711-73-1
Other Names
  • Pentyl 2-bromopropanoate
  • Propanoic acid, 2-bromo, pentyl ester
Sources

Physical Properties

Property Value Unit Source
Δf -205.56 kJ/mol Joback Calculated Property
Δfgas -432.20 kJ/mol Joback Calculated Property
Δfus 21.03 kJ/mol Joback Calculated Property
Δvap 48.61 kJ/mol Joback Calculated Property
logPoct/wat 2.503 Crippen Calculated Property
Pc 2881.21 kPa Joback Calculated Property
Tboil 524.45 K Joback Calculated Property
Tc 718.18 K Joback Calculated Property
Tfus 296.88 K Joback Calculated Property
Vc 0.564 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 320.63 J/mol×K 524.45 Joback Calculated Property
η 0.0002549 Pa×s 524.45 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

2- Bromopropionic acid, hexyl ester. BUTYL 2-BROMOPROPIONATE. 2- Bromopropionic acid, heptyl ester. 2- Bromopropionic acid, octyl ester. Nonyl 2-bromopropanoate. 2- Bromopropionic acid, tetradecyl ester. 2- Bromopropionic acid, tridecyl ester. 2- Bromopropionic acid, hexadecyl ester. 2- Bromopropionic acid, pentadecyl ester. 2- Bromopropionic acid, octadecyl ester. 2-Bromopropionic acid, 3-methylbutyl ester. Butanoic acid, 2-bromo-, pentyl ester. Propyl 2-bromopropanoate. Hexyl 2-bromobutanoate. Propanoic acid, 2,3-dibromo, pentyl ester.

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