Chemical Properties of 4-Penten-2-ol, bromoacetate

4-Penten-2-ol, bromoacetate

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InChI
InChI=1S/C7H11BrO2/c1-3-4-6(2)10-7(9)5-8/h3,6H,1,4-5H2,2H3
InChI Key
CJFYOQXFISOMFE-UHFFFAOYSA-N
Formula
C7H11BrO2
SMILES
C=CCC(C)OC(=O)CBr
Molecular Weight1
207.07
Sources

Physical Properties

Property Value Unit Source
Δf -126.14 kJ/mol Joback Calculated Property
Δfgas -286.13 kJ/mol Joback Calculated Property
Δfus 17.16 kJ/mol Joback Calculated Property
Δvap 45.71 kJ/mol Joback Calculated Property
logPoct/wat 1.89 Crippen Calculated Property
Pc 3360.64 kPa Joback Calculated Property
Tboil 498.25 K Joback Calculated Property
Tc 698.62 K Joback Calculated Property
Tfus 283.85 K Joback Calculated Property
Vc 0.49 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 259.41 J/mol×K 498.25 Joback Calculated Property
η 0.00 Pa×s 498.25 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

4-Penten-2-ol, dibromoacetate. Bromoacetic acid, 2-butyl ester. 4-Penten-2-ol, acetate. 4-Penten-2-ol, tribromoacetate. 3-Buten-1-ol, bromoacetate. 1,6-Heptadien-4-ol, acetate. Propanoic acid, 1-methyl-3-butenyl ester. Bromoacetic acid, 2-pentyl ester. Acetic acid, bromo, 1,2-dimethylpropyl ester. Acetic acid, dibromo, 1-methylpropyl ester. Acetic acid, bromo, 1,1-dimethylpropyl ester. 4-Penten-2-ol, chloroacetate. 4-Hepten-2-ol, (Z)-, acetate. 4-Hepten-2-ol, (E)-, acetate. Butanoic acid, 1-methyl-3-butenyl ester.

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