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101420-64-8 | Benzimidazole,6-methyl-4-nitro-(6CI)
CAS No: 101420-64-8 Catalog No: AG009KBU MDL No:
Product Description
Catalog Number:
AG009KBU
Chemical Name:
Benzimidazole,6-methyl-4-nitro-(6CI)
CAS Number:
101420-64-8
IUPAC Name:
6-methyl-4-nitro-1H-benzimidazole
InChI:
InChI=1S/C8H7N3O2/c1-5-2-6-8(10-4-9-6)7(3-5)11(12)13/h2-4H,1H3,(H,9,10)
InChI Key:
LZGGIVJGTACOLD-UHFFFAOYSA-N
Properties
Complexity:
216
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.054g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
177.163g/mol
Monoisotopic Mass:
177.054g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
74.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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