7-Bromo-5-chloro-1H-indole

C₈H₅BrClNCAS 292636-08-9230.49 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₈H₅BrClN
Molar mass: 230.49 g/mol
Exact mass: 228.9294 Da
logP: 3.58Crippen estimate
Polar surface area: 15.8 Å²
H-bond donors / acceptors: 1 / 0
Rotatable bonds: 0

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

292636-08-9

SMILES

C1=CNC2=C(C=C(C=C21)Cl)Br

InChIKey

CBQDZTGRYHTJRO-UHFFFAOYSA-N

InChI

InChI=1S/C8H5BrClN/c9-7-4-6(10)3-5-1-2-11-8(5)7/h1-4,11H

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Names and synonyms

1 names

7-Bromo-5-chloroindole

Work with 7-Bromo-5-chloro-1H-indole

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

7-Bromoindole51417-51-759 % similar 7-Bromo-1H-pyrrolo[3,2-c]pyridine902837-42-748 % similar 5-Chloroindole17422-32-147 % similar 5-Chloro-7-azaindole866546-07-844 % similar 7-Chloroindole53924-05-344 % similar 1-Bromo-2,3,5-trichlorobenzene81067-38-144 % similar 6-Chloroindole17422-33-242 % similar 2,6-Dibromo-4-chloroaniline874-17-942 % similar

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

Same formula

5-Bromo-6-chloro-1H-indole122531-09-3 2-(Bromomethyl)-3-chlorobenzonitrile77533-18-7

Elsewhere

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