chempirical

Methyl 4-methoxycinnamate

C11H12O3CAS 832-01-9192.21 g/mol

Open in Covalent MOL file
OOO
AlkeneEsterEther

Properties

Molecular formula
C11H12O3
Molar mass
192.21 g/mol
Exact mass
192.0786 Da
Melting point
89 °C
Boiling point
110 °C (at 0.01 Torr)
logP
1.88Crippen estimate
Polar surface area
35.5 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
3

Identifiers

CAS number
832-01-9
SMILES
COC(=O)C=Cc1ccc(OC)cc1
InChIKey
VEZIKIAGFYZTCI-UHFFFAOYSA-N
InChI
InChI=1S/C11H12O3/c1-13-10-6-3-9(4-7-10)5-8-11(12)14-2/h3-8H,1-2H3

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Type any one amount. The others follow from the molar mass.

Names and synonyms

8 names
  • 2-Propenoic acid, 3-(4-methoxyphenyl)-, methyl ester
  • Cinnamic acid, p-methoxy-, methyl ester
  • Methyl p-methoxycinnamate
  • Methyl 3-(4-methoxyphenyl)-2-propenoate
  • 3-(4-Methoxyphenyl)-2-propenoic acid methyl ester
  • NSC 26461
  • Methyl 3-(4-methoxyphenyl)acrylate
  • Methyl 3-(4-methoxyphenyl)propenoate

Work with Methyl 4-methoxycinnamate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Methyl 3-(4-formylphenyl)-2-propenoate7560-50-168 % similar Ethyl (E)-4-methoxycinnamate24393-56-468 % similar Methyl cinnamate103-26-467 % similar Methyl P-coumarate3943-97-366 % similar Methyl 3-(4-chlorophenyl)-2-propenoate7560-44-366 % similar 4,4′-Dimethoxychalcone2373-89-963 % similar 4-Methoxycinnamic acid830-09-161 % similar trans-4-Methoxycinnamic acid943-89-561 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Dehydrozingerone1080-12-2 Helional1205-17-0 Ethyl 3-phenylglycidate121-39-1 (3-Methoxyphenyl)methyl 2-propenoate144261-46-1 δ-Oxobenzenepentanoic acid1501-05-9 1-(4-Methoxyphenyl)cyclopropanecarboxylic acid16728-01-1 5,6-Dimethoxy-1-indanone2107-69-9 4-(4-Methylphenyl)-4-oxobutanoic acid4619-20-9

Elsewhere

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