Home Halogens Methyl 6-chloro-5-(trifluoromethyl)nicotinate

Methyl 6-chloro-5-(trifluoromethyl)nicotinate

CAS No.:
1360952-35-7
Catalog Number:
AG009JPE
Molecular Formula:
C8H5ClF3NO2
Molecular Weight:
239.5790
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$330
- +
1g
95%
1 week
United States
$766
- +
5g
95%
1 week
United States
$2221
- +
Product Description
Catalog Number:
AG009JPE
Chemical Name:
Methyl 6-chloro-5-(trifluoromethyl)nicotinate
CAS Number:
1360952-35-7
Molecular Formula:
C8H5ClF3NO2
Molecular Weight:
239.5790
MDL Number:
MFCD22559931
IUPAC Name:
methyl 6-chloro-5-(trifluoromethyl)pyridine-3-carboxylate
InChI:
InChI=1S/C8H5ClF3NO2/c1-15-7(14)4-2-5(8(10,11)12)6(9)13-3-4/h2-3H,1H3
InChI Key:
XSNQVMGVGAAMPU-UHFFFAOYSA-N
SMILES:
COC(=O)c1cnc(c(c1)C(F)(F)F)Cl
Properties
Complexity:
247  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.996g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
239.578g/mol
Monoisotopic Mass:
238.996g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties