Chemical Properties of 2-Propenoic acid, methyl ester (CAS 96-33-3)

2-Propenoic acid, methyl ester

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InChI
InChI=1S/C4H6O2/c1-3-4(5)6-2/h3H,1H2,2H3
InChI Key
BAPJBEWLBFYGME-UHFFFAOYSA-N
Formula
C4H6O2
SMILES
C=CC(=O)OC
Molecular Weight1
86.09
CAS
96-33-3
Other Names
  • Acrylate de methyle
  • Acrylic acid methyl ester
  • Acrylsaeuremethylester
  • CH2=CHCOOCH3
  • Curithane 103
  • Methoxycarbonylethylene
  • Methyl 2-propenoate
  • Methyl acrylate
  • Methyl ester acrylic acid
  • Methyl ester of 2-propenoic acid
  • Methyl prop-2-enoate
  • Methyl propenate
  • Methyl propenoate
  • Methyl-acrylat
  • Methylacrylaat
  • Methylester kyseliny akrylove
  • Metilacrilato
  • NSC 24146
  • UN 1919
Sources

Physical Properties

Property Value Unit Source
PAff 825.80 kJ/mol NIST
BasG 794.80 kJ/mol NIST
Δcliquid -2069.40 ± 0.67 kJ/mol NIST
Δf -163.28 kJ/mol Joback Calculated Property
Δfgas -333.00 kJ/mol NIST
Δfliquid -362.20 kJ/mol NIST
Δfus 7.62 kJ/mol Joback Calculated Property
Δvap 29.20 kJ/mol NIST
Δvap 29.20 kJ/mol NIST
IE 9.90 eV NIST
IE 10.74 eV NIST
IE 10.72 eV NIST
logPoct/wat 0.35 Crippen Calculated Property
Pc 4362.63 kPa Joback Calculated Property
Tboil [353.00; 354.10] K Show Hide
Tboil 353.70 K NIST
Tboil 353.00 K NIST
Tboil 354.10 ± 0.60 K NIST
Tboil 353.00 ± 2.00 K NIST
Tc 547.06 K Joback Calculated Property
Tfus 197.50 K NIST
Tfus 197.50 ± 0.20 K NIST
Vc 0.26 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 116.32 J/mol×K 363.89 Joback Calculated Property
Cp,liquid 133.40 J/mol×K 297.0 NIST
Cp,liquid 172.30 J/mol×K 298.15 NIST
Cp,liquid 161.50 J/mol×K 298.15 NIST
η 0.00 Pa×s 363.89 Joback Calculated Property
ΔfusH 9.73 kJ/mol 197.5 NIST
ΔfusH 9.73 kJ/mol 197.5 NIST
ΔfusH 9.73 kJ/mol 197.5 NIST
ΔvapH 38.00 kJ/mol 291.0 NIST
ΔvapH 28.80 kJ/mol 318.0 NIST
ΔvapH 34.20 kJ/mol 335.0 NIST
ΔfusS 49.26 J/mol×K 197.5 NIST

Molecular Descriptors

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

Similar Compounds

2-Propenoic acid, ethyl ester. 2-Butenoic acid, methyl ester. 2-Butenoic acid, methyl ester, (Z)-. Methyl (E)-2-butenoate. 2-Butenoic acid, methyl ester, (E)-. 2-Propenoic acid, ethenyl ester. 2-Propenoic acid, 3-iodo, methyl ester, (Z)-. trans Methyl 3-iodo-2-propenoate. Methyl trans-3-chloropropenoate. trans Methyl 3-chloro-2-propenoate. 2-Propenoic acid, 3-bromo-, methyl ester, (Z)-. 2-Propenoic acid, 3-chloro-, methyl ester, (Z)-. 2-Propenoic acid, 2-propenyl ester. 2-Propenoic acid, 3-bromo-, methyl ester, (E)-. Methyl cis-3-chloropropenoate.

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