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64826-45-5 | 1,3-Dimethyl-2-Oxo-2,3-Dihydro-1H-Benzoimidazole-5-Carboxylic Acid
CAS No: 64826-45-5 Catalog No: AG00371W MDL No:MFCD03721869
Product Description
Catalog Number:
AG00371W
Chemical Name:
1,3-Dimethyl-2-Oxo-2,3-Dihydro-1H-Benzoimidazole-5-Carboxylic Acid
CAS Number:
64826-45-5
Molecular Formula:
C10H10N2O3
Molecular Weight:
206.1980
MDL Number:
MFCD03721869
IUPAC Name:
1,3-dimethyl-2-oxobenzimidazole-5-carboxylic acid
InChI:
InChI=1S/C10H10N2O3/c1-11-7-4-3-6(9(13)14)5-8(7)12(2)10(11)15/h3-5H,1-2H3,(H,13,14)
InChI Key:
YADNYMAVRMDIDZ-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc2c(c1)n(C)c(=O)n2C
Properties
Complexity:
305
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.069g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
206.201g/mol
Monoisotopic Mass:
206.069g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
60.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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