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35469-61-5 | 2-[(E)-2-Phenylethenyl]pyridin-1-ium-1-olate
CAS No: 35469-61-5 Catalog No: AG01EVOB MDL No:
Product Description
Catalog Number:
AG01EVOB
Chemical Name:
2-[(E)-2-Phenylethenyl]pyridin-1-ium-1-olate
CAS Number:
35469-61-5
Molecular Formula:
C13H11NO
Molecular Weight:
197.2325
IUPAC Name:
1-oxido-2-[(E)-2-phenylethenyl]pyridin-1-ium
InChI:
InChI=1S/C13H11NO/c15-14-11-5-4-8-13(14)10-9-12-6-2-1-3-7-12/h1-11H/b10-9+
InChI Key:
HLPYKDBFDQXXAM-MDZDMXLPSA-N
SMILES:
[O-][n+]1ccccc1/C=C/c1ccccc1
Properties
Complexity:
209
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
197.084g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
197.237g/mol
Monoisotopic Mass:
197.084g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
25.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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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