2,3-Dimethoxybenzamide

C9H11NO3CAS 1521-39-7181.19 g/mol

Open in Covalent MOL file
OH2NOO
Ether

Properties

Molecular formula
C9H11NO3
Molar mass
181.19 g/mol
Exact mass
181.0739 Da
Melting point
236–237 °C
logP
1.59Crippen estimate
Polar surface area
62.5 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
3

Hazards

Warning
Irritant (GHS07)

Aggregated from 40 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P270, P301+P317, P330, P501

Identifiers

CAS number
1521-39-7
SMILES
COc1cccc(C(=N)O)c1OC
InChIKey
SDYIZAANGZBOSO-UHFFFAOYSA-N
InChI
InChI=1S/C9H11NO3/c1-12-7-5-3-4-6(9(10)11)8(7)13-2/h3-5H,1-2H3,(H2,10,11)

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Names and synonyms

4 names
  • Benzamide, 2,3-dimethoxy-
  • o-Veratramide
  • NSC 2353
  • NSC 40843

Work with 2,3-Dimethoxybenzamide

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

Similar compounds

2-Methoxybenzamide2439-77-272 % similar 2,3-Dimethoxybenzoic acid1521-38-666 % similar 1,2,3-Trimethoxybenzene634-36-653 % similar 3,4,5-Trimethoxybenzamide3086-62-253 % similar 2-Ethoxybenzamide938-73-849 % similar 2-Methoxybenzoic acid529-75-949 % similar o-Anisic acid579-75-949 % similar 2,3-Dimethoxyphenol5150-42-549 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

(2R,3S)-3-Phenylisoserine136561-53-0 3,4-Dimethoxybenzamide1521-41-1 3,5-Dimethoxybenzamide17213-58-0 2-Amino-2-(4-methoxyphenyl)acetic acid19789-59-4 (±)-O-Tyrosine2370-61-8 3-Acetyl-4,5-dimethyl-1H-pyrrole-2-carboxylic acid2386-33-6 Methyl 2-amino-5-methoxybenzoate2475-80-1 Methyl 3-amino-4-methoxybenzoate24812-90-6

Elsewhere

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