Chemical Properties of 3-Pentenoic acid, 4-methyl-, methyl ester (CAS 2258-65-3)

3-Pentenoic acid, 4-methyl-, methyl ester

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InChI
InChI=1S/C7H12O2/c1-6(2)4-5-7(8)9-3/h4H,5H2,1-3H3
InChI Key
UBZQAEZHQYZZJG-UHFFFAOYSA-N
Formula
C7H12O2
SMILES
COC(=O)CC=C(C)C
Molecular Weight1
128.17
CAS
2258-65-3
Other Names
  • methyl 4-methyl-3-pentenoate
Sources

Physical Properties

Property Value Unit Source
Δf -154.19 kJ/mol Joback Calculated Property
Δfgas -325.18 kJ/mol Joback Calculated Property
Δfus 15.56 kJ/mol Joback Calculated Property
Δvap 40.37 kJ/mol Joback Calculated Property
logPoct/wat 1.52 Crippen Calculated Property
Pc 3131.49 kPa Joback Calculated Property
Tboil 439.89 K Joback Calculated Property
Tc 628.49 K Joback Calculated Property
Tfus 221.77 K Joback Calculated Property
Vc 0.43 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 222.62 J/mol×K 439.89 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

(Z)-3-Pentenoic acid, methyl ester. 3-Pentenoic acid, methyl ester. 3-Pentenoic acid, 4-methyl-. 3-Hexenoic acid, methyl ester, (E)-. 3-Hexenoic acid, methyl ester. 3-Hexenoic acid, methyl ester, (Z)-. (Z)-3-Pentenoic acid ethyl ester. Methyl 3-butenoate. methyl 3-methyl-3-pentenoate. 3-Octenoic acid, methyl ester, (E)-. 3-Octenoic acid, methyl ester, (Z)-. 3-Hexenoic acid, ethyl ester, (E)-. 3-Hexenoic acid, ethyl ester. 3-Hexenoic acid, ethyl ester, (Z)-. 2-Pentenedioic acid, dimethyl ester.

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