1-Methyl-5-chloroindoline methylbromide

HCID 36077

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Basic information

CAS: 32179-45-6
Standard SMILES: C[N+]1(C)CCc2cc(Cl)ccc21.[Br-]
InChIKey: ZXPXDDSGVSXVAR-UHFFFAOYSA-M
Molecular formula: C10H13BrClN
Average molar mass: 262.57 g/mol
Monoisotopic mass: 260.99199

Names & identifiers

Preferred name: 1-Methyl-5-chloroindoline methylbromide
IUPAC: 5-chloro-1,1-dimethyl-2,3-dihydroindol-1-ium bromide
English name: S-6
Molecular formula: C10H13BrClN
Molecular weight: 262.57392

Names & synonyms

1-Methyl-5-chloroindoline methylbromide32179-45-6RefChem:76342S 6 (Pharmaceutical)INDOLINIUM, 5-CHLORO-1,1-DIMETHYL-, BROMIDE1H-Indolium, 5-chloro-2,3-dihydro-1,1-dimethyl-, bromide5-chloro-1,1-dimethyl-2,3-dihydroindol-1-ium;bromideDTXSID909540435-Chloro-1,1-dimethyl-2,3-dihydro-1H-indol-1-ium bromide

Database identifiers

CAS: 32179-45-6
PubChem CID: 36077
DTXSID: DTXSID90954043

Properties

Computed structural properties

Topological polar surface area: 0 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 1
Rotatable bonds: 0
Heavy atoms: 13
Formal charge: 0
Complexity: 179

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