Chemical Properties of (Z)-3-Pentenoic acid ethyl ester (CAS 27829-70-5)

(Z)-3-Pentenoic acid ethyl ester

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InChI
InChI=1S/C7H12O2/c1-3-5-6-7(8)9-4-2/h3,5H,4,6H2,1-2H3/b5-3+
InChI Key
UMLQAWUDAFCGGS-HWKANZROSA-N
Formula
C7H12O2
SMILES
CC=CCC(=O)OCC
Molecular Weight1
128.17
CAS
27829-70-5
Sources

Physical Properties

Property Value Unit Source
Δcliquid -4037.00 ± 3.00 kJ/mol NIST
Δf -145.64 kJ/mol Joback Calculated Property
Δfgas -387.00 ± 4.00 kJ/mol NIST
Δfliquid -432.00 ± 3.00 kJ/mol NIST
Δfus 16.88 kJ/mol Joback Calculated Property
Δvap 45.00 ± 1.00 kJ/mol NIST
Δvap 45.00 kJ/mol NIST
logPoct/wat 1.52 Crippen Calculated Property
Pc 3114.04 kPa Joback Calculated Property
Tboil 440.01 K Joback Calculated Property
Tc 625.03 K Joback Calculated Property
Tfus 235.73 K Joback Calculated Property
Vc 0.43 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 222.68 J/mol×K 440.01 Joback Calculated Property
η 0.00 Pa×s 440.01 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

3-Hexenoic acid, ethyl ester, (E)-. 3-Hexenoic acid, ethyl ester, (Z)-. 3-Hexenoic acid, ethyl ester. 3-Butenoic acid, ethyl ester. 3-Pentenoic acid, methyl ester. (Z)-3-Pentenoic acid, methyl ester. 3-Pentenoic acid 2-methylpropyl ester. 3-Octenoic acid, ethyl ester. 3-Octenoic acid, ethyl ester, (Z)-. (E)-3-hexenyl (Z)-3-hexenoate. (Z)-hex-3-enyl (Z)-hex-3-enoate. 3-Pentenoic acid, 1,1-dimethylethyl ester, (Z)-. Tert-butyl trans-3-pentenoate. 3-Butenoic acid, propyl ester. butyl (E)-3-hexenoate.

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