chempirical

2-Ethoxyphenylacetic acid

C10H12O3CAS 70289-12-2180.20 g/mol

Open in Covalent MOL file
OOHO
Carboxylic acidEther

Properties

Molecular formula
C10H12O3
Molar mass
180.20 g/mol
Exact mass
180.0786 Da
logP
1.71Crippen estimate
Polar surface area
46.5 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
4

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
70289-12-2
SMILES
CCOC1=CC=CC=C1CC(=O)O
InChIKey
ABROWERIMKBDEW-UHFFFAOYSA-N
InChI
InChI=1S/C10H12O3/c1-2-13-9-6-4-3-5-8(9)7-10(11)12/h3-6H,2,7H2,1H3,(H,11,12)

Weigh it out

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Work with 2-Ethoxyphenylacetic acid

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

2-Methoxyphenylacetic acid93-25-467 % similar 2-(Benzyloxy)phenylacetic acid22047-88-766 % similar 2-Phenoxyphenylacetic acid25563-02-461 % similar 1,2-Benzenediacetic acid7500-53-059 % similar 2-(Trifluoromethoxy)benzeneacetic acid220239-67-859 % similar 3,4-Diethoxybenzeneacetic acid38464-04-957 % similar 2-Ethoxybenzenemethanol71672-75-856 % similar (2-Methylphenyl)acetic acid644-36-054 % 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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