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Home > Imidazoles > 35681-40-4
35681-40-4 | 2H-Benzimidazol-2-one, 1,3-dihydro-1-(1-methylethyl)-
CAS No: 35681-40-4 Catalog No: AG00I732 MDL No:MFCD01067639
Product Description
Catalog Number:
AG00I732
Chemical Name:
2H-Benzimidazol-2-one, 1,3-dihydro-1-(1-methylethyl)-
CAS Number:
35681-40-4
Molecular Formula:
C10H12N2O
Molecular Weight:
176.2151
MDL Number:
MFCD01067639
IUPAC Name:
3-propan-2-yl-1H-benzimidazol-2-one
InChI:
InChI=1S/C10H12N2O/c1-7(2)12-9-6-4-3-5-8(9)11-10(12)13/h3-7H,1-2H3,(H,11,13)
InChI Key:
IKWYGATUQXCBFU-UHFFFAOYSA-N
SMILES:
CC(n1c(=O)[nH]c2c1cccc2)C
Properties
Complexity:
215
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.095g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
176.219g/mol
Monoisotopic Mass:
176.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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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