Home Nitriles 2-Chloro-6-methyl-5-nitronicotinonitrile

2-Chloro-6-methyl-5-nitronicotinonitrile

CAS No.:
26820-34-8
Catalog Number:
AG01EN1S
Molecular Formula:
C7H4ClN3O2
Molecular Weight:
197.5786
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Product Description
Catalog Number:
AG01EN1S
Chemical Name:
2-Chloro-6-methyl-5-nitronicotinonitrile
CAS Number:
26820-34-8
Molecular Formula:
C7H4ClN3O2
Molecular Weight:
197.5786
MDL Number:
MFCD16877634
IUPAC Name:
2-chloro-6-methyl-5-nitropyridine-3-carbonitrile
InChI:
InChI=1S/C7H4ClN3O2/c1-4-6(11(12)13)2-5(3-9)7(8)10-4/h2H,1H3
InChI Key:
FVZWFEILQHGLRN-UHFFFAOYSA-N
SMILES:
N#Cc1cc([N+](=O)[O-])c(nc1Cl)C
Properties
Complexity:
256  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.999g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
197.578g/mol
Monoisotopic Mass:
196.999g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
82.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties