5,7-Dichloroisatin

C₈H₃Cl₂NO₂CAS 6374-92-1216.02 g/mol

Open in Covalent MOL file

Amide Aryl halide Ketone Lactam

Properties

Molecular formula: C₈H₃Cl₂NO₂
Molar mass: 216.02 g/mol
Exact mass: 214.9541 Da
Melting point: 313 °C
logP: 2.13Crippen estimate
Polar surface area: 46.2 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 0

Identifiers

CAS number

6374-92-1

SMILES

O=C1Nc2c(Cl)cc(Cl)cc2C1=O

InChIKey

AYGGQJHJRFZDFH-UHFFFAOYSA-N

InChI

InChI=1S/C8H3Cl2NO2/c9-3-1-4-6(5(10)2-3)11-8(13)7(4)12/h1-2H,(H,11,12,13)

Weigh it out

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

Names and synonyms

5 names

1H-Indole-2,3-dione, 5,7-dichloro-
Indole-2,3-dione, 5,7-dichloro-
Isatin, 5,7-dichloro-
5,7-Dichloro-1H-indole-2,3-dione
NSC 26045

Work with 5,7-Dichloroisatin

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

5-Chloroisatin17630-76-154 % similar 5,7-Dimethylisatin39603-24-245 % similar 7-Bromoisatin20780-74-944 % similar 7-Methylisatin1127-59-943 % similar (2,4,6-Trichlorophenyl)hydrazine5329-12-442 % similar 2,3,5-Trichlorobenzoic acid50-73-740 % similar 3,5-Dichlorosalicylic acid320-72-939 % similar 3,5-Dichloroanthranilic acid2789-92-638 % similar

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

Same formula

4,7-Dichloroisatin18711-13-2 4,6-Dichloro-1H-indole-2,3-dione18711-15-4

Elsewhere

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