chempirical

1-Phenylisatin

C14H9NO2CAS 723-89-7223.23 g/mol

Open in Covalent MOL file
OON
AmideKetoneLactam

Properties

Molecular formula
C14H9NO2
Molar mass
223.23 g/mol
Exact mass
223.0633 Da
Melting point
138 °C
logP
2.55Crippen estimate
Polar surface area
37.4 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
1

Identifiers

CAS number
723-89-7
SMILES
O=C1C(=O)N(c2ccccc2)c2ccccc21
InChIKey
UWCPWBIMRYXUOU-UHFFFAOYSA-N
InChI
InChI=1S/C14H9NO2/c16-13-11-8-4-5-9-12(11)15(14(13)17)10-6-2-1-3-7-10/h1-9H

Weigh it out

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

Names and synonyms

9 names
  • 1H-Indole-2,3-dione, 1-phenyl-
  • Indole-2,3-dione, 1-phenyl-
  • Isatin, 1-phenyl-
  • 1-Phenyl-1H-indole-2,3-dione
  • N-Phenylisatin
  • NSC 100013
  • 1-Phenyl-2,3-indolinedione
  • 1-Phenylindole-2,3-dione
  • 1-Phenyl-2,3-dihydro-1H-indole-2,3-dione

Work with 1-Phenylisatin

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

1-Methylisatin2058-74-456 % similar Acetylisatin574-17-451 % similar N,N-Diphenylcarbamic chloride83-01-242 % similar 1,3-Dihydro-1-phenyl-2H-indol-2-one3335-98-642 % similar N,N-Diphenylacetamide519-87-941 % similar Dichlone117-80-639 % similar 1,2-Bis(2-chlorophenyl)-1,2-ethanedione21854-95-538 % similar Phenanthrenequinone84-11-738 % similar

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

Same formula

2-Aminoanthraquinone117-79-3 N-Phenylphthalimide520-03-6 9-Nitroanthracene602-60-8 1-Aminoanthraquinone82-45-1

Elsewhere

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