Chemical Properties of 3-Octenyl propionate (CAS 94133-58-1)

3-Octenyl propionate

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InChI
InChI=1S/C11H20O2/c1-3-5-6-7-8-9-10-13-11(12)4-2/h7-8H,3-6,9-10H2,1-2H3/b8-7+
InChI Key
NTQOADMSKSBQCI-BQYQJAHWSA-N
Formula
C11H20O2
SMILES
CCCCC=CCCOC(=O)CC
Molecular Weight1
184.28
CAS
94133-58-1
Other Names
  • oct-3-enyl propionate
Sources

Physical Properties

Property Value Unit Source
Δf -111.96 kJ/mol Joback Calculated Property
Δfgas -397.95 kJ/mol Joback Calculated Property
Δfus 27.23 kJ/mol Joback Calculated Property
Δvap 49.19 kJ/mol Joback Calculated Property
logPoct/wat 3.08 Crippen Calculated Property
Pc 2111.94 kPa Joback Calculated Property
Tboil 531.53 K Joback Calculated Property
Tc 709.61 K Joback Calculated Property
Tfus 280.81 K Joback Calculated Property
Vc 0.66 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 397.35 J/mol×K 531.53 Joback Calculated Property
η 0.00 Pa×s 531.53 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-CH2- 6
>C=O (nonring) 1
=CH- 2
-CH3 2

Similar Compounds

cis-3-Heptenyl propionate. trans-3-Heptenyl propionate. 3-Octen-1-ol, butanoate, (E)-. hex-3-enyl propanoate. 3-Hexen-1-ol, propanoate, (Z)-. Propanoic acid, (E)-3-hexenyl ester. 3-Octen-1-ol, acetate, (Z)-. 3-Octenyl acetate. trans-3-Heptenyl butanoate. cis-3-Heptenyl butyrate. (Z)-3-Decenyl butyrate. Acetic acid, non-3-enyl ester, cis-. (Z)-3-Nonen-1-yl acetate. (Z)-3-Heptenyl acetate. (E)-3-Heptenyl acetate.

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