Home Nitriles 3-Pyridinecarbonitrile, 1,6-dihydro-2-methoxy-6-oxo-

3-Pyridinecarbonitrile, 1,6-dihydro-2-methoxy-6-oxo-

CAS No.:
130747-60-3
Catalog Number:
AG000UWQ
Molecular Formula:
C7H6N2O2
Molecular Weight:
150.1347
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Product Description
Catalog Number:
AG000UWQ
Chemical Name:
3-Pyridinecarbonitrile, 1,6-dihydro-2-methoxy-6-oxo-
CAS Number:
130747-60-3
Molecular Formula:
C7H6N2O2
Molecular Weight:
150.1347
MDL Number:
MFCD18384893
IUPAC Name:
2-methoxy-6-oxo-1H-pyridine-3-carbonitrile
InChI:
InChI=1S/C7H6N2O2/c1-11-7-5(4-8)2-3-6(10)9-7/h2-3H,1H3,(H,9,10)
InChI Key:
FBTBUFBHIVYSKS-UHFFFAOYSA-N
SMILES:
COc1c(ccc(=O)[nH]1)C#N
Properties
Complexity:
293  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.043g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
150.137g/mol
Monoisotopic Mass:
150.043g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
62.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2  
Properties