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1260883-50-8 | 1H-Benzimidazol-7-amine, 6-bromo-
CAS No: 1260883-50-8 Catalog No: AG000RJE MDL No:MFCD11040196
Product Description
Catalog Number:
AG000RJE
Chemical Name:
1H-Benzimidazol-7-amine, 6-bromo-
CAS Number:
1260883-50-8
Molecular Formula:
C7H6BrN3
Molecular Weight:
212.0466
MDL Number:
MFCD11040196
IUPAC Name:
5-bromo-1H-benzimidazol-4-amine
InChI:
InChI=1S/C7H6BrN3/c8-4-1-2-5-7(6(4)9)11-3-10-5/h1-3H,9H2,(H,10,11)
InChI Key:
DHUKVHRPLYJHAM-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1N)[nH]cn2
Properties
Complexity:
153
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.975g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
212.05g/mol
Monoisotopic Mass:
210.975g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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