chempirical

Ethyl 4-hydroxyphenylacetate

C10H12O3CAS 17138-28-2180.20 g/mol

Open in Covalent MOL file
OOOH
EsterPhenol

Properties

Molecular formula
C10H12O3
Molar mass
180.20 g/mol
Exact mass
180.0786 Da
Melting point
37 °C
Boiling point
155–157 °C (at 1.5 Torr)
logP
1.50Crippen estimate
Polar surface area
46.5 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
3

Identifiers

CAS number
17138-28-2
SMILES
CCOC(=O)Cc1ccc(O)cc1
InChIKey
HYUPPKVFCGIMDB-UHFFFAOYSA-N
InChI
InChI=1S/C10H12O3/c1-2-13-10(12)7-8-3-5-9(11)6-4-8/h3-6,11H,2,7H2,1H3

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Names and synonyms

7 names
  • Benzeneacetic acid, 4-hydroxy-, ethyl ester
  • Acetic acid, (p-hydroxyphenyl)-, ethyl ester
  • Ethyl (p-hydroxyphenyl)acetate
  • Ethyl 2-(4-hydroxyphenyl)acetate
  • (4-Hydroxyphenyl)acetic acid ethyl ester
  • Ethyl 2-(p-hydroxyphenyl)acetate
  • 2-(4-Hydroxyphenyl)acetic acid ethyl ester

Work with Ethyl 4-hydroxyphenylacetate

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 2-(4-bromophenyl)acetate14062-25-071 % similar Ethyl p-tolylacetate14062-19-268 % similar Ethyl phenylacetate101-97-367 % similar p-Chlorophenylacetic acid ethyl ester14062-24-966 % similar Methyl (4-hydroxyphenyl)acetate14199-15-665 % similar Ethyl p-methoxyphenylacetate14062-18-164 % similar Ethyl 4-pyridineacetate54401-85-363 % similar (Dimethylcarbamoyl)methyl 2-(4-hydroxyphenyl)acetate59721-16-360 % similar

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

Same formula

(R)-(+)-2-Benzyloxypropionic acid100836-85-9 Anisyl acetate104-21-2 3-(3-Methoxyphenyl)propionic acid10516-71-9 (-)-Ethyl mandelate10606-72-1 3-Ethoxy-4-methoxybenzaldehyde1131-52-8 3,4-Dimethoxyacetophenone1131-62-0 2′,5′-Dimethoxyacetophenone1201-38-3 4-Ethoxy-3-methoxybenzaldehyde120-25-2

Elsewhere

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