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6692-36-0 | 1-Methyl-α-(3-nitrophenyl)-1H-benzimidazole-2-methanol
CAS No: 6692-36-0 Catalog No: AG00FU5N MDL No:
Product Description
Catalog Number:
AG00FU5N
Chemical Name:
1-Methyl-α-(3-nitrophenyl)-1H-benzimidazole-2-methanol
CAS Number:
6692-36-0
IUPAC Name:
(1-methylbenzimidazol-2-yl)-(3-nitrophenyl)methanol
InChI:
InChI=1S/C15H13N3O3/c1-17-13-8-3-2-7-12(13)16-15(17)14(19)10-5-4-6-11(9-10)18(20)21/h2-9,14,19H,1H3
InChI Key:
QDWJPOONCBBGHE-UHFFFAOYSA-N
Properties
Complexity:
387
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.096g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
283.287g/mol
Monoisotopic Mass:
283.096g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
83.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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