Chemical Properties of hexyl (E)-2-hexenoate (CAS 33855-57-1)

hexyl (E)-2-hexenoate

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InChI
InChI=1S/C12H22O2/c1-3-5-7-9-11-14-12(13)10-8-6-4-2/h8,10H,3-7,9,11H2,1-2H3/b10-8+
InChI Key
NGQTTWDHJIMWOI-CSKARUKUSA-N
Formula
C12H22O2
SMILES
CCCC=CC(=O)OCCCCCC
Molecular Weight1
198.30
CAS
33855-57-1
Other Names
  • 2-Hexenoic acid, hexyl ester, (2E)-
  • hexyl (E)-hex-2-enoate
Sources

Physical Properties

Property Value Unit Source
Δf -103.54 kJ/mol Joback Calculated Property
Δfgas -418.59 kJ/mol Joback Calculated Property
Δfus 29.82 kJ/mol Joback Calculated Property
Δvap 51.42 kJ/mol Joback Calculated Property
logPoct/wat 3.47 Crippen Calculated Property
Pc 1937.24 kPa Joback Calculated Property
Tboil 554.41 K Joback Calculated Property
Tc 730.90 K Joback Calculated Property
Tfus 292.08 K Joback Calculated Property
Vc 0.71 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 445.74 J/mol×K 554.41 Joback Calculated Property
η 0.00 Pa×s 554.41 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-CH2- 7
>C=O (nonring) 1
=CH- 2
-CH3 2

Similar Compounds

2-Heptenoic acid, hexyl ester. 2-Heptenoic acid, heptyl ester. 2-Heptenoic acid, pentyl ester. 2-Heptenoic acid, heptadecyl ester. 2-Heptenoic acid, octadecyl ester. 2-Heptenoic acid, pentadecyl ester. 2-Heptenoic acid, octyl ester. 2-Heptenoic acid, hexadecyl ester. 2-Heptenoic acid, tetradecyl ester. 2-Heptenoic acid, tridecyl ester. 2-Heptenoic acid, undecyl ester. 2-Heptenoic acid, nonyl ester. 2-Heptenoic acid, dodecyl ester. 2-Hexenoic acid, butyl ester, (e)-. 2-Heptenoic acid, butyl ester.

Find more compounds similar to hexyl (E)-2-hexenoate.

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