6-Bromo-5-methyl-1H-indole

C₉H₈BrNCAS 248602-16-6210.07 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₉H₈BrN
Molar mass: 210.07 g/mol
Exact mass: 208.9840 Da
logP: 3.24Crippen estimate
Polar surface area: 15.8 Å²
H-bond donors / acceptors: 1 / 0
Rotatable bonds: 0

Identifiers

CAS number

248602-16-6

SMILES

Cc1cc2cc[nH]c2cc1Br

InChIKey

DZPFAUCRIATHQM-UHFFFAOYSA-N

InChI

InChI=1S/C9H8BrN/c1-6-4-7-2-3-11-9(7)5-8(6)10/h2-5,11H,1H3

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Names and synonyms

2 names

1H-Indole, 6-bromo-5-methyl-
6-Bromo-5-methylindole

Work with 6-Bromo-5-methyl-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

5-Bromo-6-chloro-1H-indole122531-09-353 % similar 6-Bromo-5-methyl (1H)indazole1000343-69-051 % similar 2,5-Dibromo-P-xylene1074-24-448 % similar 5,6-Dihydroxyindole3131-52-047 % similar 5-Methylindole614-96-047 % similar 1,5-Dibromo-2,4-dimethylbenzene615-87-246 % similar 5-Bromoindole10075-50-045 % similar 6-Bromoindole52415-29-945 % similar

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

Same formula

5-Bromo-1-methyl-1H-indole10075-52-2 5-Bromo-2-methylindole1075-34-9

Elsewhere

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