Chemical Properties of 2-Propenoic acid, 3-(4-hydroxy-3-methoxyphenyl)- (CAS 1135-24-6)

2-Propenoic acid, 3-(4-hydroxy-3-methoxyphenyl)-

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InChI
InChI=1S/C10H10O4/c1-14-9-6-7(2-4-8(9)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13)
InChI Key
KSEBMYQBYZTDHS-UHFFFAOYSA-N
Formula
C10H10O4
SMILES
COc1cc(C=CC(=O)O)ccc1O
Molecular Weight1
194.18
CAS
1135-24-6
Other Names
  • 3-(4-Hydroxy-3-methoxyphenyl)-2-propenoic acid
  • 3-(4-Hydroxy-3-methoxyphenyl)acrylic acid
  • 3-Methoxy-4-hydroxycinnamic acid
  • 4-Hydroxy-3-methoxycinnamic acid
  • 4-Hydroxy-3-methoxycinnamic acid (ferulic acid)
  • Cinnamic acid, 4-hydroxy-3-methoxy-
  • Ferulic acid
Sources

Physical Properties

Property Value Unit Source
Δf -309.04 kJ/mol Joback Calculated Property
Δfgas -481.79 kJ/mol Joback Calculated Property
Δfus 28.17 kJ/mol Joback Calculated Property
Δvap 79.60 kJ/mol Joback Calculated Property
logPoct/wat 1.50 Crippen Calculated Property
Pc 4311.22 kPa Joback Calculated Property
Tboil 713.11 K Joback Calculated Property
Tc 929.21 K Joback Calculated Property
Tfus 481.02 K Joback Calculated Property
Vc 0.48 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 370.82 J/mol×K 713.11 Joback Calculated Property
η 0.00 Pa×s 713.11 Joback Calculated Property
ΔfusH 17.89 kJ/mol 435.3 NIST
ΔfusH 33.34 kJ/mol 444.6 NIST
ΔsubH 132.40 ± 1.30 kJ/mol 379.5 NIST

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-CH3 1
=CH- (ring) 3
-OH (alcohol) 1
=C< (ring) 3
=CH- 2
>C=O (nonring) 1
-OH (phenol) 1

Similar Compounds

trans-Ferulic acid. (Z)-3,4-Dimethoxycinnamic acid. 3,4-Dimethoxycinnamic acid. 2-Propenoic acid, 3-(3,4-dimethoxyphenyl)-, (E)-. 2-Propenoic acid, 3-(4-hydroxy-3-methoxyphenyl)-, methyl ester. 2-Propenal, 3-(4-hydroxy-3-methoxyphenyl)-. 3-Hydroxy-4-methoxycinnamic acid. Phenol, 4-(3-hydroxy-1-propenyl)-2-methoxy-. 4-(1 E)-3-hydroxy-1-propenyl-2-methoxyphenol. 4-((1E)-3-Hydroxy-1-propenyl)-2-methoxyphenol. (E)-4-(3-Hydroxyprop-1-en-1-yl)-2-methoxyphenol. Ferulic acid ethyl ester. 2-Propenoic acid, 3-(3,4,5-trimethoxyphenyl)-, methyl ester, cis. 2-Propenoic acid, 3-(3,4-dimethoxyphenyl)-, methyl ester, trans. 2-Propenoic acid, 3-(3,4-dimethoxyphenyl)-, methyl ester.

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