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5-Chloro-1H-benzo[d]imidazole-1,2-diamine

HCID 356349
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Basic information

CAS
60882-71-5
Standard SMILES
Nc1nc2cc(Cl)ccc2n1N
InChIKey
BWPDDCOWXFNALZ-UHFFFAOYSA-N
Molecular formula
C7H7ClN4
Average molar mass
182.61 g/mol
Monoisotopic mass
182.0359239

Names & identifiers

Preferred name
5-Chloro-1H-benzo[d]imidazole-1,2-diamine
IUPAC
5-chlorobenzimidazole-1,2-diamine
English name
1H-Benzimidazole-1,2-diamine,5-chloro-(9CI)
Molecular formula
C7H7ClN4
Molecular weight
182.61

Names & synonyms

5-Chloro-1H-benzo[d]imidazole-1,2-diamine60882-71-5NSC611783MLS0033739365-chlorobenzimidazole-1,2-diamine1H-Benzimidazole-1,2-diamine, 5-chloro-SCHEMBL2946987CHEMBL1974134DTXSID401288178NSC-6117835-Chloro-1H-benzimidazole-1,2-diamineNCI60_004859
Show more names
1H-Benzimidazole-1,2-diamine,5-chloro-(9CI)
SMR002048727

Database identifiers

CAS
60882-71-5
PubChem CID
356349
DTXSID
DTXSID401288178
ChEMBL
CHEMBL1974134

Properties

Computed structural properties

XLogP
1.8
Topological polar surface area
69.9 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
0
Heavy atoms
12
Formal charge
0
Complexity
177

Related reactions

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Compound notes

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