2',4'-Dihydroxy-3'-methylacetophenone

C₉H₁₀O₃CAS 10139-84-1166.18 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₉H₁₀O₃
Molar mass: 166.18 g/mol
Exact mass: 166.0630 Da
logP: 1.61Crippen estimate
Polar surface area: 57.5 Å²
H-bond donors / acceptors: 2 / 3
Rotatable bonds: 1

Identifiers

CAS number

10139-84-1

SMILES

CC1=C(C=CC(=C1O)C(=O)C)O

InChIKey

KMTLZBUHQPQFAV-UHFFFAOYSA-N

InChI

InChI=1S/C9H10O3/c1-5-8(11)4-3-7(6(2)10)9(5)12/h3-4,11-12H,1-2H3

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Names and synonyms

1 names

1-(2,4-Dihydroxy-3-methylphenyl)ethan-1-one

Work with 2',4'-Dihydroxy-3'-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 Isotope patternExact mass and the mass spectrum pattern

Same formula

(4-Methoxyphenyl)acetic acid104-01-8 Ethyl salicylate118-61-6 Veratraldehyde120-14-9 Ethylparaben120-47-8 Ethylvanillin121-32-4 Methyl anisate121-98-2 2-Ethoxybenzoic acid134-11-2 Methyl (4-hydroxyphenyl)acetate14199-15-6

Elsewhere

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