chempirical

1-(2-Ethoxyphenyl)ethanone

C10H12O2CAS 2142-67-8164.20 g/mol

Open in Covalent MOL file
OO
EtherKetone

Properties

Molecular formula
C10H12O2
Molar mass
164.20 g/mol
Exact mass
164.0837 Da
Melting point
36–40 °C
logP
2.29Crippen estimate
Polar surface area
26.3 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
3

Identifiers

CAS number
2142-67-8
SMILES
CCOc1ccccc1C(C)=O
InChIKey
TVGMOUGXQYQZOL-UHFFFAOYSA-N
InChI
InChI=1S/C10H12O2/c1-3-12-10-7-5-4-6-9(10)8(2)11/h4-7H,3H2,1-2H3

Weigh it out

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

Names and synonyms

5 names
  • Ethanone, 1-(2-ethoxyphenyl)-
  • Acetophenone, 2′-ethoxy-
  • 2′-Ethoxyacetophenone
  • o-Ethoxyacetophenone
  • 1-(2-Ethoxyphenyl)ethan-1-one

Work with 1-(2-Ethoxyphenyl)ethanone

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-Ethoxybenzoic acid134-11-263 % similar 2-Ethoxybenzoyl chloride42926-52-363 % similar Ethyl 2-ethoxybenzoate6290-24-063 % similar Methyl 2-ethoxybenzoate3686-55-361 % similar 2′-Methoxyacetophenone579-74-861 % similar 1,2-Diethoxybenzene2050-46-655 % similar 1,2-Diacetylbenzene704-00-755 % similar 1-[2-(Benzoyloxy)phenyl]ethanone4010-33-754 % similar

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

Same formula

4′-Hydroxybutyrophenone1009-11-6 Ethyl phenylacetate101-97-3 Methyl 3-phenylpropionate103-25-3 Phenethyl acetate103-45-7 Ethyl 3-methylbenzoate120-33-2 1-(4-Methoxyphenyl)-1-propanone121-97-1 Benzyl propionate122-63-4 4-Methoxyphenylacetone122-84-9

Elsewhere

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