2-Methoxyphenyl acetate

C9H10O3CAS 15212-03-0166.18 g/mol

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Properties

Molecular formula
C9H10O3
Molar mass
166.18 g/mol
Exact mass
166.0630 Da
Density
1.127–1.134 g/mL
Melting point
31.5 °C
Boiling point
240–241 °C
logP
1.62Crippen estimate
Polar surface area
35.5 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Aggregated from 116 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P280, P302+P352, P321, P332+P317, P362+P364

Identifiers

CAS number
15212-03-0
SMILES
CC(=O)OC1=CC=CC=C1OC
InChIKey
BHJHPYFAYGAPLS-UHFFFAOYSA-N
InChI
InChI=1S/C9H10O3/c1-7(10)12-9-6-4-3-5-8(9)11-2/h3-6H,1-2H3

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Names and synonyms

1 names
  • Guaiacyl acetate

Work with 2-Methoxyphenyl acetate

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

Guacetisal55482-89-876 % similar Guaiacol carbonate553-17-366 % similar 2-Methylphenyl acetate533-18-661 % similar Pyrogallol triacetate525-52-060 % similar 2-Chlorophenyl acetate4525-75-159 % similar Guaiacol benzoate531-37-358 % similar 1-Naphthyl acetate830-81-958 % similar Methyl 2-acetoxybenzoate580-02-957 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2',4'-Dihydroxy-3'-methylacetophenone10139-84-1 (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

Elsewhere

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