Chemical Properties of 3-methylbut-2-en-1-yl 3-methylbutanoate

3-methylbut-2-en-1-yl 3-methylbutanoate

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InChI
InChI=1S/C10H18O2/c1-8(2)5-6-12-10(11)7-9(3)4/h5,9H,6-7H2,1-4H3
InChI Key
SXWCTQGESRWYMK-UHFFFAOYSA-N
Formula
C10H18O2
SMILES
CC(C)=CCOC(=O)CC(C)C
Molecular Weight1
170.25
Other Names
  • Isopentenyl isovalerate
Sources

Physical Properties

Property Value Unit Source
Δf -131.37 kJ/mol Joback Calculated Property
Δfgas -392.38 kJ/mol Joback Calculated Property
Δfus 19.81 kJ/mol Joback Calculated Property
Δvap 46.66 kJ/mol Joback Calculated Property
logPoct/wat 2.54 Crippen Calculated Property
Pc 2340.56 kPa Joback Calculated Property
Tboil 508.09 K Joback Calculated Property
Tc 694.82 K Joback Calculated Property
Tfus 240.58 K Joback Calculated Property
Vc 0.59 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 350.82 J/mol×K 508.09 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 1
=C< 1
>C=O (nonring) 1
-CH2- 2
=CH- 1
-CH3 4

Similar Compounds

Butanoic acid, 3-methylbut-2-enyl ester. Isovaleric acid, allyl ester-. Valeric acid, 3-methylbut-2-enyl ester. Butanoic acid, 3-methyl-, 2-hexenyl ester, (E)-. (Z)-3-Hexenyl 3-methylbutyrate. (E)-hex-2-enyl isovalerate. 4-Bromobutanoic acid, 3-methylbut-2-enyl ester. Hexanoic acid, 3-methyl-2-butenyl ester. Succinic acid, 3-methylbutyl 3-methylbut-2-enyl ester. Glutaric acid, 3-methylbut-2-en-1-yl 3-methylbutyl ester. 3-methylbut-2-en-1-yl 2-methylbutanoate. Sebacic acid, di(3-methylbut-2-enyl) ester. Octanoic acid, 3-methylbut-2-enyl ester. Glutaric acid, ethyl 3-methylbut-2-enyl ester. Glutaric acid, di(3-methylbut-2-enyl) ester.

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