chempirical

Methyl 2-methoxybenzoate

C9H10O3CAS 606-45-1166.18 g/mol

Open in Covalent MOL file
OOO
EsterEther

Properties

Molecular formula
C9H10O3
Molar mass
166.18 g/mol
Exact mass
166.0630 Da
Density
1.1467 g/mL (at 20 °C)
Boiling point
246.5 °C
logP
1.48Crippen estimate
Polar surface area
35.5 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
2

Identifiers

CAS number
606-45-1
SMILES
COC(=O)c1ccccc1OC
InChIKey
PFYHAAAQPNMZHO-UHFFFAOYSA-N
InChI
InChI=1S/C9H10O3/c1-11-8-6-4-3-5-7(8)9(10)12-2/h3-6H,1-2H3

Weigh it out

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

Names and synonyms

9 names
  • Benzoic acid, 2-methoxy-, methyl ester
  • o-Anisic acid, methyl ester
  • Benzoic acid, o-methoxy-, methyl ester
  • Methyl o-methoxybenzoate
  • o-Methoxybenzoic acid methyl ester
  • Methyl o-anisate
  • 2-Methoxybenzoic acid methyl ester
  • NSC 406256
  • Methyl 2-anisate

Work with Methyl 2-methoxybenzoate

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

Dimethyl phthalate131-11-370 % similar Methyl 2-hydroxy-3-methoxybenzoate6342-70-768 % similar Methyl 2-ethoxybenzoate3686-55-365 % similar Methyl 2-acetoxybenzoate580-02-965 % similar Ethyl 2-methoxybenzoate7335-26-465 % similar Methyl 2,6-dimethoxybenzoate2065-27-265 % similar Methyl anthranilate134-20-363 % similar Methyl 2,4-dimethoxybenzoate2150-41-662 % 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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