Chemical Properties of (Z)-Hex-3-enyl 3-chlorobenzoate

(Z)-Hex-3-enyl 3-chlorobenzoate

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InChI
InChI=1S/C13H15ClO2/c1-2-3-4-5-9-16-13(15)11-7-6-8-12(14)10-11/h3-4,6-8,10H,2,5,9H2,1H3/b4-3-
InChI Key
PSTUDEYXVHRFJN-ARJAWSKDSA-N
Formula
C13H15ClO2
SMILES
CCC=CCCOC(=O)c1cccc(Cl)c1
Molecular Weight1
238.71
Other Names
  • Benzoic acid, 3-chloro, (Z)-3-hexenyl ester
Sources

Physical Properties

Property Value Unit Source
Δf -4.27 kJ/mol Joback Calculated Property
Δfgas -229.91 kJ/mol Joback Calculated Property
Δfus 30.26 kJ/mol Joback Calculated Property
Δvap 60.97 kJ/mol Joback Calculated Property
logPoct/wat 3.853 Crippen Calculated Property
Pc 2291.52 kPa Joback Calculated Property
Tboil 646.38 K Joback Calculated Property
Tc 862.28 K Joback Calculated Property
Tfus 372.21 K Joback Calculated Property
Vc 0.709 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 449.70 J/mol×K 646.38 Joback Calculated Property
η 0.0001338 Pa×s 646.38 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-Cl 1
=CH- (ring) 4
=C< (ring) 2
-CH2- 3
=CH- 2
-CH3 1
>C=O (nonring) 1

Similar Compounds

(E)-Hex-3-enyl 3-chlorobenzoate. (Z)-Non-3-enyl 3-chlorobenzoate. But-3-enyl 3-chlorobenzoate. Benzoic acid, 3-chloro, propyl ester. Isobutyl 3-chlorobenzoate. 3-Methylbut-3-enyl 3-chlorobenzoate. Butyl 3-chlorobenzoate. (Z)-Dec-4-enyl 3-chlorobenzoate. Benzoic acid, 3-chloro, 1-methyl-3-butenyl ester. 3-Chlorobenzoic acid, neopentyl ester. Pent-4-enyl 3-chlorobenzoate. Benzoic acid, 3-chloro, 1-methylpropyl ester. Benzoic acid, 3-chloro, pentyl ester. Benzoic acid, 3-chloro-, ethyl ester. Benzoic acid, 3-chloro, 3-methylbutyl ester.

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