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49819-79-6 | 1H-Benzimidazole,1,2-dimethyl-5-nitro-(9CI)
CAS No: 49819-79-6 Catalog No: AG00DWJL MDL No:
Product Description
Catalog Number:
AG00DWJL
Chemical Name:
1H-Benzimidazole,1,2-dimethyl-5-nitro-(9CI)
CAS Number:
49819-79-6
IUPAC Name:
1,2-dimethyl-5-nitrobenzimidazole
InChI:
InChI=1S/C9H9N3O2/c1-6-10-8-5-7(12(13)14)3-4-9(8)11(6)2/h3-5H,1-2H3
InChI Key:
CRRGPIBVQLNTRN-UHFFFAOYSA-N
Properties
Complexity:
241
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.069g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
191.19g/mol
Monoisotopic Mass:
191.069g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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