Home Halogens Ethyl 2-chloro-3-cyano-6-methylisonicotinate

Ethyl 2-chloro-3-cyano-6-methylisonicotinate

CAS No.:
40108-12-1
Catalog Number:
AG003QHT
Molecular Formula:
C10H9ClN2O2
Molecular Weight:
224.6437
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
1 week
United States
$160
- +
Product Description
Catalog Number:
AG003QHT
Chemical Name:
Ethyl 2-chloro-3-cyano-6-methylisonicotinate
CAS Number:
40108-12-1
Molecular Formula:
C10H9ClN2O2
Molecular Weight:
224.6437
MDL Number:
MFCD00023416
IUPAC Name:
ethyl 2-chloro-3-cyano-6-methylpyridine-4-carboxylate
InChI:
InChI=1S/C10H9ClN2O2/c1-3-15-10(14)7-4-6(2)13-9(11)8(7)5-12/h4H,3H2,1-2H3
InChI Key:
XUXBHWPRQGVLRY-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cc(C)nc(c1C#N)Cl
NSC Number:
108204
Properties
Complexity:
286  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.035g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.644g/mol
Monoisotopic Mass:
224.035g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
63A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties