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64457-68-7 | 1H-Benzimidazole,6-methoxy-4-nitro-(9CI)
CAS No: 64457-68-7 Catalog No: AG00EWCY MDL No:
Product Description
Catalog Number:
AG00EWCY
Chemical Name:
1H-Benzimidazole,6-methoxy-4-nitro-(9CI)
CAS Number:
64457-68-7
IUPAC Name:
6-methoxy-4-nitro-1H-benzimidazole
InChI:
InChI=1S/C8H7N3O3/c1-14-5-2-6-8(10-4-9-6)7(3-5)11(12)13/h2-4H,1H3,(H,9,10)
InChI Key:
LOYMXVWISJDUCD-UHFFFAOYSA-N
Properties
Complexity:
230
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.049g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
193.162g/mol
Monoisotopic Mass:
193.049g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
83.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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