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Home > Pyridines > 150630-13-0
150630-13-0 | 4-Pyridinol, 2-methyl-3-(phenylmethoxy)-
CAS No: 150630-13-0 Catalog No: AG001MS7 MDL No:MFCD02180546
Product Description
Catalog Number:
AG001MS7
Chemical Name:
4-Pyridinol, 2-methyl-3-(phenylmethoxy)-
CAS Number:
150630-13-0
Molecular Formula:
C13H13NO2
Molecular Weight:
215.2478
MDL Number:
MFCD02180546
IUPAC Name:
2-methyl-3-phenylmethoxy-1H-pyridin-4-one
InChI:
InChI=1S/C13H13NO2/c1-10-13(12(15)7-8-14-10)16-9-11-5-3-2-4-6-11/h2-8H,9H2,1H3,(H,14,15)
InChI Key:
WBKGCSWOAILTET-UHFFFAOYSA-N
SMILES:
Oc1ccnc(c1OCc1ccccc1)C
Properties
Complexity:
325
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.095g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
215.252g/mol
Monoisotopic Mass:
215.095g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38.3A^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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