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Home > Imidazoles > 77557-01-8
77557-01-8 | 2H-Benzimidazol-2-one,1,3-dihydro-1-propyl-
CAS No: 77557-01-8 Catalog No: AG005GSL MDL No:MFCD02707887
Product Description
Catalog Number:
AG005GSL
Chemical Name:
2H-Benzimidazol-2-one,1,3-dihydro-1-propyl-
CAS Number:
77557-01-8
Molecular Formula:
C10H12N2O
Molecular Weight:
176.2151
MDL Number:
MFCD02707887
IUPAC Name:
3-propyl-1H-benzimidazol-2-one
InChI:
InChI=1S/C10H12N2O/c1-2-7-12-9-6-4-3-5-8(9)11-10(12)13/h3-6H,2,7H2,1H3,(H,11,13)
InChI Key:
YNFLIDHXMNKSQR-UHFFFAOYSA-N
SMILES:
CCCn1c(=O)[nH]c2c1cccc2
Properties
Complexity:
205
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:
2
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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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