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20928-63-6 | 2(1H)-Pyridinone, 3-methoxy-
CAS No: 20928-63-6 Catalog No: AG002K5E MDL No:MFCD00006015
Product Description
Catalog Number:
AG002K5E
Chemical Name:
2(1H)-Pyridinone, 3-methoxy-
CAS Number:
20928-63-6
Molecular Formula:
C6H7NO2
Molecular Weight:
125.1253
MDL Number:
MFCD00006015
IUPAC Name:
3-methoxy-1H-pyridin-2-one
InChI:
InChI=1S/C6H7NO2/c1-9-5-3-2-4-7-6(5)8/h2-4H,1H3,(H,7,8)
InChI Key:
LKIMDXQLHFCXQF-UHFFFAOYSA-N
SMILES:
COc1ccc[nH]c1=O
EC Number:
244-116-1
NSC Number:
282188
Properties
Complexity:
182
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
125.048g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
125.127g/mol
Monoisotopic Mass:
125.048g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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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