4′-Hydroxy-2′-methylacetophenone

C9H10O2CAS 875-59-2150.18 g/mol

Open in Covalent MOL file
OOH
KetonePhenol

Properties

Molecular formula
C9H10O2
Molar mass
150.18 g/mol
Exact mass
150.0681 Da
Melting point
128 °C
Boiling point
313 °C
logP
1.90Crippen estimate
Polar surface area
37.3 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from 41 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
875-59-2
SMILES
CC(=O)c1ccc(O)cc1C
InChIKey
IAMNVCJECQWBLZ-UHFFFAOYSA-N
InChI
InChI=1S/C9H10O2/c1-6-5-8(11)3-4-9(6)7(2)10/h3-5,11H,1-2H3

Weigh it out

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

Names and synonyms

8 names
  • Ethanone, 1-(4-hydroxy-2-methylphenyl)-
  • Acetophenone, 4′-hydroxy-2′-methyl-
  • 1-(4-Hydroxy-2-methylphenyl)ethanone
  • 2′-Methyl-4′-hydroxyacetophenone
  • 4-Acetyl-3-methylphenol
  • NSC 63364
  • 2-Methyl-4-hydroxyacetophenone
  • 4-Hydroxy-2-methylacetophenone

Work with 4′-Hydroxy-2′-methylacetophenone

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2′,4′-Dihydroxyacetophenone89-84-966 % similar 4-Hydroxy-2-methylbenzoic acid578-39-264 % similar 2′,4′-Dimethylacetophenone89-74-763 % similar 1-(2-Bromo-4-hydroxyphenyl)ethanone61791-99-962 % similar 1-(2-Chloro-4-hydroxyphenyl)ethanone68301-59-762 % similar 4-Acetyl-3-fluorophenol98619-07-962 % similar 2,5-Dihydroxyacetophenone490-78-861 % similar Methyl 4-hydroxy-2-methylbenzoate57556-31-758 % 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

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