Home Halogens 3-chloro-n-(3-chloro-2,6-dinitro-4-trifluoromethylphenyl)-5-trifluoromethyl-2-pyridylamine

3-chloro-n-(3-chloro-2,6-dinitro-4-trifluoromethylphenyl)-5-trifluoromethyl-2-pyridylamine

CAS No.:
79622-59-6
Catalog Number:
AG008LVK
Molecular Formula:
C13H4Cl2F6N4O4
Molecular Weight:
465.0917
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
99%(HPLC)
In Stock USA
United States
$46
- +
25mg
99%(HPLC)
In Stock USA
United States
$73
- +
100mg
99%(HPLC)
In Stock USA
United States
$156
- +
Product Description
Catalog Number:
AG008LVK
Chemical Name:
3-chloro-n-(3-chloro-2,6-dinitro-4-trifluoromethylphenyl)-5-trifluoromethyl-2-pyridylamine
CAS Number:
79622-59-6
Molecular Formula:
C13H4Cl2F6N4O4
Molecular Weight:
465.0917
MDL Number:
MFCD00214168
IUPAC Name:
3-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-5-(trifluoromethyl)pyridin-2-amine
InChI:
InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)
InChI Key:
UZCGKGPEKUCDTF-UHFFFAOYSA-N
SMILES:
Clc1cc(cnc1Nc1c(cc(c(c1[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F
UNII:
0P91PCK33Q
RTECS Number:
UR8085000
Properties
Complexity:
628  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
463.951g/mol
Formal Charge:
0
Heavy Atom Count:
29  
Hydrogen Bond Acceptor Count:
12  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
465.089g/mol
Monoisotopic Mass:
463.951g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
117A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6  
Literature
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Properties