2-Chloro-6-(4,5-dichloro-1H-pyrrol-3-yl)aniline

HCID 367483

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Basic information

CAS: 124201-43-0
Standard SMILES: Nc1c(Cl)cccc1-c1c[nH]c(Cl)c1Cl
InChIKey: BPFFQNOQBLYXCP-UHFFFAOYSA-N
Molecular formula: C10H7Cl3N2
Average molar mass: 261.5 g/mol
Monoisotopic mass: 259.967481

Names & identifiers

Preferred name: 2-Chloro-6-(4,5-dichloro-1H-pyrrol-3-yl)aniline
IUPAC: 2-chloro-6-(4,5-dichloro-1H-pyrrol-3-yl)aniline

Names & synonyms

2-Chloro-6-(4,5-dichloro-1H-pyrrol-3-yl)aniline124201-43-0NSC6372752,3-Dichloro-4-(2-amino-3-chlorophenyl)pyrroleDTXSID50327214NSC-637275SB637522,3-dichloro-4-(2-amino-3-chlorophenyl)-pyrrole2-Chloro-6-(4,5-dichloro-1H-pyrrol-3-yl)phenylamine

Database identifiers

CAS: 124201-43-0
PubChem CID: 367483
DTXSID: DTXSID50327214
Nikkaji: J330.637B

Properties

Computed structural properties

XLogP: 3.9
Topological polar surface area: 41.8 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 1
Rotatable bonds: 1
Heavy atoms: 15
Formal charge: 0
Complexity: 227

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