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14178-29-1 | Methanone, (1-oxido-4-pyridinyl)phenyl-
CAS No: 14178-29-1 Catalog No: AG001H6A MDL No:
Product Description
Catalog Number:
AG001H6A
Chemical Name:
Methanone, (1-oxido-4-pyridinyl)phenyl-
CAS Number:
14178-29-1
Molecular Formula:
C12H9NO2
Molecular Weight:
199.2054
IUPAC Name:
(1-oxidopyridin-1-ium-4-yl)-phenylmethanone
InChI:
InChI=1S/C12H9NO2/c14-12(10-4-2-1-3-5-10)11-6-8-13(15)9-7-11/h1-9H
InChI Key:
UQNSTGILJBPJQN-UHFFFAOYSA-N
SMILES:
[O-][n+]1ccc(cc1)C(=O)c1ccccc1
Properties
Complexity:
216
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.063g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
199.209g/mol
Monoisotopic Mass:
199.063g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
42.5A^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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