2'-Methoxyacetophenone

C9H10O2CAS 579-74-8150.18 g/mol

Open in Covalent MOL file
OO
EtherKetone

Properties

Molecular formula
C9H10O2
Molar mass
150.18 g/mol
Exact mass
150.0681 Da
Density
1.088–1.092 g/mL
Boiling point
100–110 °C (at 6 Torr)
logP
1.90Crippen estimate
Polar surface area
26.3 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Aggregated from 40 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, P501

Identifiers

CAS number
579-74-8
SMILES
COc1ccccc1C(C)=O
InChIKey
DWPLEOPKBWNPQV-UHFFFAOYSA-N
InChI
InChI=1S/C9H10O2/c1-7(10)8-5-3-4-6-9(8)11-2/h3-6H,1-2H3

Weigh it out

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

Names and synonyms

15 names · show all
  • 2′-Methoxyacetophenone
  • Ethanone, 1-(2-methoxyphenyl)-
  • Acetophenone, 2′-methoxy-
  • Acetophenone, o-methoxy-
  • 1-(2-Methoxyphenyl)ethanone
  • o-Methoxyacetophenone
  • o-Acetylanisole
  • Methyl o-methoxyphenyl ketone
  • Methyl 2-methoxyphenyl ketone
  • 2-Methoxyphenyl methyl ketone
  • 2-Acetylanisole
  • NSC 23387
  • NSC 26912
  • 2-Methoxy-1-acetylbenzene
  • 1-(2-Methoxyphenyl)ethan-1-one

Work with 2'-Methoxyacetophenone

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

1-(2,6-Dimethoxyphenyl)ethanone2040-04-263 % similar 1,2-Diacetylbenzene704-00-762 % similar 2',5'-Dimethoxyacetophenone1201-38-361 % similar 1-(2-Ethoxyphenyl)ethanone2142-67-861 % similar 2′,4′-Dimethoxyacetophenone829-20-961 % similar 2-Methoxybenzoyl chloride21615-34-959 % similar 2-Methoxybenzoic acid529-75-959 % similar o-Anisic acid579-75-959 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Acetanisole100-06-1 4-Ethoxybenzaldehyde10031-82-0 Methyl phenylacetate101-41-7 (2,3-Dihydro-1-benzofuran-5-yl)methanol103262-35-7 2-Phenylethyl formate104-62-1 Hydroxychavicol1126-61-0 3-Methylphenyl acetate122-46-3 Phenyl glycidyl ether122-60-1

Elsewhere

PubChem CAS Common Chemistry NIST WebBook