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2683-66-1 | 4-(Benzyloxy)Pyridine N-Oxide
CAS No: 2683-66-1 Catalog No: AG003K67 MDL No:MFCD00047427
Product Description
Catalog Number:
AG003K67
Chemical Name:
4-(Benzyloxy)Pyridine N-Oxide
CAS Number:
2683-66-1
Molecular Formula:
C12H11NO2
Molecular Weight:
201.2212
MDL Number:
MFCD00047427
IUPAC Name:
1-oxido-4-phenylmethoxypyridin-1-ium
InChI:
InChI=1S/C12H11NO2/c14-13-8-6-12(7-9-13)15-10-11-4-2-1-3-5-11/h1-9H,10H2
InChI Key:
SUSQPKJQYWTFPU-UHFFFAOYSA-N
SMILES:
[O-][n+]1ccc(cc1)OCc1ccccc1
NSC Number:
165489
Properties
Complexity:
173
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.079g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
201.225g/mol
Monoisotopic Mass:
201.079g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
34.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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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