Home Aminos Benzimidazole, 2-amino-4-methoxy-1-methyl- (8CI)

Benzimidazole, 2-amino-4-methoxy-1-methyl- (8CI)

CAS No.:
33235-33-5
Catalog Number:
AG00CNFY
Molecular Formula:
C9H11N3O
Molecular Weight:
177.2031
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Product Description
Catalog Number:
AG00CNFY
Chemical Name:
Benzimidazole, 2-amino-4-methoxy-1-methyl- (8CI)
CAS Number:
33235-33-5
Molecular Formula:
C9H11N3O
Molecular Weight:
177.2031
MDL Number:
MFCD18825732
IUPAC Name:
4-methoxy-1-methylbenzimidazol-2-amine
InChI:
InChI=1S/C9H11N3O/c1-12-6-4-3-5-7(13-2)8(6)11-9(12)10/h3-5H,1-2H3,(H2,10,11)
InChI Key:
RNJUSLPNRVXPPT-UHFFFAOYSA-N
SMILES:
COc1cccc2c1nc(n2C)N
Properties
Complexity:
188  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.09g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
177.207g/mol
Monoisotopic Mass:
177.09g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
53.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties