Chemical Properties of butyl 5-octenoate

butyl 5-octenoate

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InChI
InChI=1S/C12H22O2/c1-3-5-7-8-9-10-12(13)14-11-6-4-2/h5,7H,3-4,6,8-11H2,1-2H3/b7-5+
InChI Key
HDJMWWQMTPKOHY-FNORWQNLSA-N
Formula
C12H22O2
SMILES
CCC=CCCCC(=O)OCCCC
Molecular Weight1
198.30
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

Ethyl (Z)-5-octenoate. ethyl 5-octenoate. 5-hexenyl 5-hexenoate. isobutyl 5-octenoate. hexyl 5-hexenoate. Hex-5-enoic acid, ethyl ester. Icosa-5,8,11,14-tetraenoic acid tetradecyl ester, Z,Z,Z,Z. Icosa-5,8,11,14-tetraenoic acid icosyl ester, Z,Z,Z,Z. Icosa-5,8,11,14-tetraenoic acid docosyl ester, Z,Z,Z,Z. Icosa-5,8,11,14-tetraenoic acid hexadecyl ester, Z,Z,Z,Z. Icosa-5,8,11,14-tetraenoic acid octadecyl ester, Z,Z,Z,Z. Icosa-5,8,11,14-tetraenoic acid dodecyl ester, Z,Z,Z,Z. 5,8,11,14-Eicosatetraenoic acid, ethyl ester. (Z)-4-Hepten-1-yl pentanoate. 5-Octen-1-ol, (Z)-, 3-methylbutanoate.

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