Chemical Properties of 2-Butenoic acid, 2-methyl-, 2-propenyl ester, (e)- (CAS 7493-71-2)

2-Butenoic acid, 2-methyl-, 2-propenyl ester, (e)-

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InChI
InChI=1S/C8H12O2/c1-4-6-10-8(9)7(3)5-2/h4-5H,1,6H2,2-3H3/b7-5+
InChI Key
ODOZNBUSHKFCSH-FNORWQNLSA-N
Formula
C8H12O2
SMILES
C=CCOC(=O)C(C)=CC
Molecular Weight1
140.18
CAS
7493-71-2
Other Names
  • Allyl tiglate
  • Allyl trans-2-methyl-2-butenoate
  • Tiglic acid, allyl ester
  • allyl 2-methylcrotonate
Sources

Physical Properties

Property Value Unit Source
Δf -57.93 kJ/mol Joback Calculated Property
Δfgas -220.39 kJ/mol Joback Calculated Property
Δfus 16.88 kJ/mol Joback Calculated Property
Δvap 41.93 kJ/mol Joback Calculated Property
logPoct/wat 1.68 Crippen Calculated Property
Pc 2950.48 kPa Joback Calculated Property
Tboil 459.45 K Joback Calculated Property
Tc 650.12 K Joback Calculated Property
Tfus 231.28 K Joback Calculated Property
Vc 0.47 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 246.55 J/mol×K 459.45 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

2-Butenyl Angelate. (E)-But-2-enyl (E)-2-methylbut-2-enoate. 3-methyl-2-butenyl 2-methylcrotonate. Butenyl tiglate, 3-methyl-2-. 2-methyl-2-butenoic acid ethyl ester. 2-Butenoic acid, 2-methyl-, ethyl ester. Ethyl tiglate. Ethyl trans-2-methyl-2-butenoate. Ethyl angelate. Ethyl angelate. (Z)-Ethyl 2-methylbut-2-enoate. Methallyl angelate. 2-methylallyl 2-methylcrotonate. (Z)-(E)-2-Methylbut-2-en-1-yl 2-methylbut-2-enoate. Angelyl Angelate.

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