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Home > Imidazoles > 91085-68-6
91085-68-6 | N-(2,3-DIHYDRO-2-OXO-1H-BENZO[D]IMIDAZOL-5-YL)-ACETAMIDE
CAS No: 91085-68-6 Catalog No: AG006R1T MDL No:
Product Description
Catalog Number:
AG006R1T
Chemical Name:
N-(2,3-DIHYDRO-2-OXO-1H-BENZO[D]IMIDAZOL-5-YL)-ACETAMIDE
CAS Number:
91085-68-6
Molecular Formula:
C9H9N3O2
Molecular Weight:
191.1867
IUPAC Name:
N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide
InChI:
InChI=1S/C9H9N3O2/c1-5(13)10-6-2-3-7-8(4-6)12-9(14)11-7/h2-4H,1H3,(H,10,13)(H2,11,12,14)
InChI Key:
BTIJJZBDTRBBBF-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1ccc2c(c1)[nH]c(=O)[nH]2
Properties
Complexity:
267
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:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
191.19g/mol
Monoisotopic Mass:
191.069g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
70.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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