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89852-81-3 | 1H-Benzimidazole-4,7-diamine
CAS No: 89852-81-3 Catalog No: AG003WRT MDL No:
Product Description
Catalog Number:
AG003WRT
Chemical Name:
1H-Benzimidazole-4,7-diamine
CAS Number:
89852-81-3
Molecular Formula:
C7H8N4
Molecular Weight:
148.1652
IUPAC Name:
1H-benzimidazole-4,7-diamine
InChI:
InChI=1S/C7H8N4/c8-4-1-2-5(9)7-6(4)10-3-11-7/h1-3H,8-9H2,(H,10,11)
InChI Key:
VZHDVFUJFCMSBJ-UHFFFAOYSA-N
SMILES:
Nc1ccc(c2c1[nH]cn2)N
Properties
Complexity:
149
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
148.075g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
148.169g/mol
Monoisotopic Mass:
148.075g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
80.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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