Chemical Properties of 3-Hexenyl isobutyrate

3-Hexenyl isobutyrate

Download as PDF file Download as Excel file Download as 2D mole file Predict properties

InChI
InChI=1S/C10H18O2/c1-4-5-6-7-8-12-10(11)9(2)3/h5-6,9H,4,7-8H2,1-3H3/b6-5+
InChI Key
OSMAJVWUIUORGC-AATRIKPKSA-N
Formula
C10H18O2
SMILES
CCC=CCCOC(=O)C(C)C
Molecular Weight1
170.25
Sources

Physical Properties

Property Value Unit Source
Δf -122.82 kJ/mol Joback Calculated Property
Δfgas -382.59 kJ/mol Joback Calculated Property
Δfus 21.12 kJ/mol Joback Calculated Property
Δvap 46.58 kJ/mol Joback Calculated Property
logPoct/wat 2.54 Crippen Calculated Property
Pc 2329.27 kPa Joback Calculated Property
Tboil 508.21 K Joback Calculated Property
Tc 691.70 K Joback Calculated Property
Tfus 254.54 K Joback Calculated Property
Vc 0.59 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 350.97 J/mol×K 508.21 Joback Calculated Property
η 0.00 Pa×s 508.21 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

cis-3-Hexenyl iso-butyrate. hex-3-enyl propanoate. 3-Hexen-1-ol, propanoate, (Z)-. Propanoic acid, (E)-3-hexenyl ester. trans-3-Heptenyl propionate. cis-3-Heptenyl propionate. cis-3-Hexenyl-«alpha»-methylbutyrate. Hex-3-enyl 2-methylbutanoate. (Z)-3-hexenyl-2-methylbutanoate. 3-Octenyl propionate. Butanoic acid, 3-hexenyl ester, (E)-. 3-Hexen-1-ol, butanoate. Butanoic acid, 3-hexenyl ester, (Z)-. Propanoic acid, 3-chloro, (Z)-3-hexenyl ester. Propanoic acid, 3-chloro, (E)-3-hexenyl ester.

Find more compounds similar to 3-Hexenyl isobutyrate.

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.