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Home > Imidazoles > 7711-31-1
7711-31-1 | 1H-Benzimidazole-2-acetamide, N,N-dimethyl-1-phenyl-
CAS No: 7711-31-1 Catalog No: AG005EET MDL No:
Product Description
Catalog Number:
AG005EET
Chemical Name:
1H-Benzimidazole-2-acetamide, N,N-dimethyl-1-phenyl-
CAS Number:
7711-31-1
Molecular Formula:
C17H17N3O
Molecular Weight:
279.3364
IUPAC Name:
N,N-dimethyl-2-(1-phenylbenzimidazol-2-yl)acetamide
InChI:
InChI=1S/C17H17N3O/c1-19(2)17(21)12-16-18-14-10-6-7-11-15(14)20(16)13-8-4-3-5-9-13/h3-11H,12H2,1-2H3
InChI Key:
STBYCOLQKLHIKZ-UHFFFAOYSA-N
SMILES:
O=C(N(C)C)Cc1nc2c(n1c1ccccc1)cccc2
Properties
Complexity:
365
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.137g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
279.343g/mol
Monoisotopic Mass:
279.137g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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