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6339-38-4 | 5-CYANO-6-HYDROXY-4-METHOXYMETHYL-2-METHYLPYRIDINE
CAS No: 6339-38-4 Catalog No: AG00ERKL MDL No:
Product Description
Catalog Number:
AG00ERKL
Chemical Name:
5-CYANO-6-HYDROXY-4-METHOXYMETHYL-2-METHYLPYRIDINE
CAS Number:
6339-38-4
IUPAC Name:
4-(methoxymethyl)-6-methyl-2-oxo-1H-pyridine-3-carbonitrile
InChI:
InChI=1S/C9H10N2O2/c1-6-3-7(5-13-2)8(4-10)9(12)11-6/h3H,5H2,1-2H3,(H,11,12)
InChI Key:
KLNRUMOPNATILS-UHFFFAOYSA-N
NSC Number:
13132
Properties
Complexity:
344
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.074g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
178.191g/mol
Monoisotopic Mass:
178.074g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
62.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
| 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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