Home Nitriles 4-Oxo-1,4-dihydropyridine-3-carbonitrile

4-Oxo-1,4-dihydropyridine-3-carbonitrile

CAS No.:
100367-56-4
Catalog Number:
AG0001QP
Molecular Formula:
C6H4N2O
Molecular Weight:
120.1088
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$299
- +
1g
95%
1 week
United States
$692
- +
Product Description
Catalog Number:
AG0001QP
Chemical Name:
4-Oxo-1,4-dihydropyridine-3-carbonitrile
CAS Number:
100367-56-4
Molecular Formula:
C6H4N2O
Molecular Weight:
120.1088
MDL Number:
MFCD11046297
IUPAC Name:
4-oxo-1H-pyridine-3-carbonitrile
InChI:
InChI=1S/C6H4N2O/c7-3-5-4-8-2-1-6(5)9/h1-2,4H,(H,8,9)
InChI Key:
ZSGWFOMHWZIAEW-UHFFFAOYSA-N
SMILES:
O=c1cc[nH]cc1C#N
Properties
Complexity:
241  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
120.032g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
120.111g/mol
Monoisotopic Mass:
120.032g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
52.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Properties