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92799-41-2

92799-41-2 | Benzimidazole, 5(or 6)-methoxy-6(or 5)-methyl- (7CI)

CAS No: 92799-41-2 Catalog No: AG00H5BZ MDL No:

Product Description

Catalog Number:
AG00H5BZ
Chemical Name:
Benzimidazole, 5(or 6)-methoxy-6(or 5)-methyl- (7CI)
CAS Number:
92799-41-2
IUPAC Name:
5-methoxy-6-methyl-1H-benzimidazole
InChI:
InChI=1S/C9H10N2O/c1-6-3-7-8(11-5-10-7)4-9(6)12-2/h3-5H,1-2H3,(H,10,11)
InChI Key:
NTRDUQMAJNJZAW-UHFFFAOYSA-N

Properties

Complexity:
163  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.079g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
162.192g/mol
Monoisotopic Mass:
162.079g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  

Literature

Title Journal
Anaerobic biosynthesis of the lower ligand of vitamin B12. Proceedings of the National Academy of Sciences of the United States of America 20150825

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