chempirical

Methyl 2-oxoindoline-4-carboxylate

C10H9NO3CAS 90924-46-2191.19 g/mol

Open in Covalent MOL file
OOONH
AmideEsterLactam

Properties

Molecular formula
C10H9NO3
Molar mass
191.19 g/mol
Exact mass
191.0582 Da
logP
0.97Crippen estimate
Polar surface area
55.4 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
90924-46-2
SMILES
COC(=O)C1=C2CC(=O)NC2=CC=C1
InChIKey
FBKDEECWCACPLH-UHFFFAOYSA-N
InChI
InChI=1S/C10H9NO3/c1-14-10(13)6-3-2-4-8-7(6)5-9(12)11-8/h2-4H,5H2,1H3,(H,11,12)

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Names and synonyms

1 names
  • Methyl 2-oxindole-4-carboxylate

Work with Methyl 2-oxoindoline-4-carboxylate

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

4-Chloro-1,3-dihydro-2H-indol-2-one20870-77-353 % similar Methyl N-methylanthranilate85-91-651 % similar Dimethyl phthalate131-11-350 % similar Methyl 3-bromo-2-(bromomethyl)benzoate337536-14-850 % similar Methyl 2,3-dihydroxybenzoate2411-83-847 % similar Methyl salicylate119-36-846 % similar Methyl 2-chlorobenzoate610-96-846 % similar Methyl 2-chloronicotinate40134-18-745 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

5-Methoxy-1H-indole-3-carboxylic acid10242-01-0 4-Methoxy-1H-indole-2-carboxylic acid103260-65-7 7-Methoxy-1H-indole-3-carboxylic acid128717-77-1 5-Hydroxyindoleacetic acid1321-73-9 2-Oxo-2,3-Dihydro-1H-indole-6-carboxylic acid methyl ester14192-26-8 (S)-(-)-4-Benzyloxazolidine-2,5-dione14825-82-2 6-Methoxy-1H-indole-2-carboxylic acid16732-73-3 Methyl oxindole-5-carboxylate199328-10-4

Elsewhere

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