chempirical

Ethyl 3-methoxybenzeneacetate

C11H14O3CAS 35553-92-5194.23 g/mol

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EsterEther

Properties

Molecular formula
C11H14O3
Molar mass
194.23 g/mol
Exact mass
194.0943 Da
Melting point
125–126 °C
Boiling point
90 °C (at 0.0127 Torr)
logP
1.80Crippen estimate
Polar surface area
35.5 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
4

Identifiers

CAS number
35553-92-5
SMILES
CCOC(=O)Cc1cccc(OC)c1
InChIKey
XXVVNHCWPHMLEZ-UHFFFAOYSA-N
InChI
InChI=1S/C11H14O3/c1-3-14-11(12)8-9-5-4-6-10(7-9)13-2/h4-7H,3,8H2,1-2H3

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Names and synonyms

7 names
  • Benzeneacetic acid, 3-methoxy-, ethyl ester
  • Acetic acid, (m-methoxyphenyl)-, ethyl ester
  • Ethyl m-methoxyphenylacetate
  • Ethyl 3-methoxyphenylacetate
  • m-Methoxyphenylacetic acid ethyl ester
  • (3-Methoxyphenyl)acetic acid ethyl ester
  • Ethyl 2-(3-methoxyphenyl)acetate

Work with Ethyl 3-methoxybenzeneacetate

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

Ethyl 3,4-dimethoxybenzeneacetate18066-68-763 % similar Ethyl phenylacetate101-97-362 % similar 3′-Methoxyphenyl-2-propanone3027-13-260 % similar (3-Methoxyphenyl)acetic acid1798-09-059 % similar p-Chlorophenylacetic acid ethyl ester14062-24-954 % similar Ethyl 3-pyridineacetate39931-77-653 % similar Ethyl p-tolylacetate14062-19-251 % similar Ethyl 4-pyridineacetate54401-85-351 % similar

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

Same formula

Zingerone122-48-5 Ethyl p-methoxyphenylacetate14062-18-1 4-Butoxybenzoic acid1498-96-0 Propioveratrone1835-04-7 3,4-Diethoxybenzaldehyde2029-94-9 Butyl salicylate2052-14-4 Ethyl 4-ethoxybenzoate23676-09-7 1,1-Dimethylethyl 4-hydroxybenzoate25804-49-3

Elsewhere

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