chempirical

N-Phenylmaleamic acid

C10H9NO3CAS 555-59-9191.19 g/mol

Open in Covalent MOL file
OOHOHN
AlkeneCarboxylic acid

Properties

Molecular formula
C10H9NO3
Molar mass
191.19 g/mol
Exact mass
191.0582 Da
Melting point
192 °C (decomposes)
logP
1.92Crippen estimate
Polar surface area
69.9 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
3

Identifiers

CAS number
555-59-9
SMILES
O=C(O)/C=CC(O)=Nc1ccccc1
InChIKey
WHZLCOICKHIPRL-SREVYHEPSA-N
InChI
InChI=1S/C10H9NO3/c12-9(6-7-10(13)14)11-8-4-2-1-3-5-8/h1-7H,(H,11,12)(H,13,14)/b7-6-

Weigh it out

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

Names and synonyms

9 names
  • 2-Butenoic acid, 4-oxo-4-(phenylamino)-, (2Z)-
  • Maleanilic acid
  • 2-Butenoic acid, 4-oxo-4-(phenylamino)-, (Z)-
  • (2Z)-4-Oxo-4-(phenylamino)-2-butenoic acid
  • Maleic acid monoanilide
  • Maleanilinic acid
  • N-Phenylmaleinamic acid
  • Maleic acid monophenyl amide
  • (Z)-4-Oxo-4-(phenylamino)-2-butenoic acid

Work with N-Phenylmaleamic acid

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

(2Z)-4-Oxo-4-[(phenylmethyl)amino]-2-butenoic acid15329-69-861 % similar 4-Oxo-4-phenyl-2-butenoic acid583-06-253 % similar Cinnamic acid621-82-952 % similar 5-Phenyl-2,4-pentadienoic acid1552-94-947 % similar 3-[1,1′-Biphenyl]-4-yl-2-propenoic acid13026-23-846 % similar (2Z)-4-[(Aminocarbonyl)amino]-4-oxo-2-butenoic acid105-61-344 % similar Maleic acid110-16-744 % similar Fumaric acid110-17-844 % 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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