Home Carboxys Methyl 2-methyl-6-oxo-1,6-dihydropyridine-3-carboxylate

Methyl 2-methyl-6-oxo-1,6-dihydropyridine-3-carboxylate

CAS No.:
223788-08-7
Catalog Number:
AG003ROQ
Molecular Formula:
C8H9NO3
Molecular Weight:
167.1620
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Product Description
Catalog Number:
AG003ROQ
Chemical Name:
Methyl 2-methyl-6-oxo-1,6-dihydropyridine-3-carboxylate
CAS Number:
223788-08-7
Molecular Formula:
C8H9NO3
Molecular Weight:
167.1620
MDL Number:
MFCD18803546
IUPAC Name:
methyl 2-methyl-6-oxo-1H-pyridine-3-carboxylate
InChI:
InChI=1S/C8H9NO3/c1-5-6(8(11)12-2)3-4-7(10)9-5/h3-4H,1-2H3,(H,9,10)
InChI Key:
NYZKFYQERYBEAB-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(=O)[nH]c1C
Properties
Complexity:
289  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.058g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
167.164g/mol
Monoisotopic Mass:
167.058g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  
Properties