Home Nitriles 2-Oxo-2H-pyran-5-carbonitrile

2-Oxo-2H-pyran-5-carbonitrile

CAS No.:
129660-12-4
Catalog Number:
AG000ZA4
Molecular Formula:
C6H3NO2
Molecular Weight:
121.0935
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$358
- +
5g
95%
In Stock USA
United States
$1136
- +
Product Description
Catalog Number:
AG000ZA4
Chemical Name:
2-Oxo-2H-pyran-5-carbonitrile
CAS Number:
129660-12-4
Molecular Formula:
C6H3NO2
Molecular Weight:
121.0935
MDL Number:
MFCD22412347
IUPAC Name:
6-oxopyran-3-carbonitrile
InChI:
InChI=1S/C6H3NO2/c7-3-5-1-2-6(8)9-4-5/h1-2,4H
InChI Key:
BSKONEMTLKHESY-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(=O)oc1
Properties
Complexity:
241  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
121.016g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
121.095g/mol
Monoisotopic Mass:
121.016g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
50.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  
Properties