Home Nitriles 2-(difluoromethoxy)-4,6-dimethylnicotinonitrile

2-(difluoromethoxy)-4,6-dimethylnicotinonitrile

CAS No.:
832737-66-3
Catalog Number:
AG00JEFP
Molecular Formula:
C9H8F2N2O
Molecular Weight:
198.1694
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Product Description
Catalog Number:
AG00JEFP
Chemical Name:
2-(difluoromethoxy)-4,6-dimethylnicotinonitrile
CAS Number:
832737-66-3
Molecular Formula:
C9H8F2N2O
Molecular Weight:
198.1694
MDL Number:
MFCD04967304
IUPAC Name:
2-(difluoromethoxy)-4,6-dimethylpyridine-3-carbonitrile
InChI:
InChI=1S/C9H8F2N2O/c1-5-3-6(2)13-8(7(5)4-12)14-9(10)11/h3,9H,1-2H3
InChI Key:
LUPCBLKMOIGCQU-UHFFFAOYSA-N
SMILES:
N#Cc1c(C)cc(nc1OC(F)F)C
Properties
Complexity:
238  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.06g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
198.173g/mol
Monoisotopic Mass:
198.06g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
45.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties