2′-Hydroxy-5′-methylacetophenone

C9H10O2CAS 1450-72-2150.18 g/mol

Open in Covalent MOL file
OHO
KetonePhenol

Properties

Molecular formula
C9H10O2
Molar mass
150.18 g/mol
Exact mass
150.0681 Da
Melting point
50 °C
Boiling point
210 °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 45 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
1450-72-2
SMILES
CC(=O)c1cc(C)ccc1O
InChIKey
YNPDFBFVMJNGKZ-UHFFFAOYSA-N
InChI
InChI=1S/C9H10O2/c1-6-3-4-9(11)8(5-6)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

10 names
  • Ethanone, 1-(2-hydroxy-5-methylphenyl)-
  • Acetophenone, 2′-hydroxy-5′-methyl-
  • 1-(2-Hydroxy-5-methylphenyl)ethanone
  • 2-Acetyl-4-methylphenol
  • o-Acetyl-p-cresol
  • 5′-Methyl-2′-hydroxyacetophenone
  • NSC 26458
  • NSC 63363
  • 1-(2-Hydroxy-5-methylphenyl)ethan-1-one
  • 2-Hydroxy-5-methylacetophenone

Work with 2′-Hydroxy-5′-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′-Hydroxy-4′-methylacetophenone6921-64-874 % similar 2,5-Dihydroxyacetophenone490-78-866 % similar 5-Methylsalicylic acid89-56-564 % similar 1-(2,5-Dimethylphenyl)ethanone2142-73-663 % similar 5′-Chloro-2′-hydroxyacetophenone1450-74-462 % similar 5′-Bromo-2′-hydroxyacetophenone1450-75-562 % similar 5′-Fluoro-2′-hydroxyacetophenone394-32-162 % similar 5-Methylsalicylamide39506-61-162 % 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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