5-CHLORO-2-(METHYLSULFINOIMIDOYL)-3-(TRIFLUOROMETHYL)PYRIDINE 2,4,6-TRIMETHYLBENZENESULFONATE

Catalog No: FT-0620221

CAS No: 175203-07-3

Chemical Name: 5-CHLORO-2-(METHYLSULFINOIMIDOYL)-3-(TRIFLUOROMETHYL)PYRIDINE 2,4,6-TRIMETHYLBENZENESULFONATE
Molecular Formula: C16H18ClF3N2O3S2
Molecular Weight: 442.9
InChI Key: JLXKQLRHVQMYGD-UHFFFAOYSA-N
InChI: InChI=1S/C9H12O3S.C7H6ClF3N2S/c1-6-4-7(2)9(8(3)5-6)13(10,11)12;1-14(12)6-5(7(9,10)11)2-4(8)3-13-6/h4-5H,1-3H3,(H,10,11,12);2-3,12H,1H3

Product pricing and availability information
Assay	Pack Size	Price	Stock
98%	1g	N/A	N/A
98%	5g	N/A	N/A
98%	Bulk Quantity	N/A	N/A

Product_Name:	[5-chloro-3-(trifluoromethyl)pyridin-2-yl]-imino-methyl-λ4-sulfane,2,4,6-trimethylbenzenesulfonic acid
Flash_Point:	N/A
Melting_Point:	167 °C
FW:	442.90400
Density:	N/A
CAS:	175203-07-3
Bolling_Point:	N/A
MF:	C16H18ClF3N2O3S2

Computational_Chemistry:	['1 . XlogP 34 ', '2 . Hydrogen Bond Donor Count 0 ', '3 . Hydrogen Bond Acceptor Count 4 ', '4 . Rotatable Bond Count 6 ', '5 变异构体数量 ', '6 . TPSA 388 ', '7 . Heavy Atom Count 24 ', '8 . Topological Polar Surface Area 0 ', '9 . Complexity 392 ', '10. Isotope Atom Count 0 ', '11. Defined Atom Stereocenter Count 0 ', '12. Undefined Atom Stereocenter Count 0 ', '13. Defined Bond Stereocenter Count 0 ', '14. Undefined Bond Stereocenter Count 0 ', '15. Covalently-Bonded Unit Count 1']
LogP:	6.81280
Melting_Point:	167 °C
FW:	442.90400
PSA:	118.70000
MF:	C16H18ClF3N2O3S2
More_Info:	['1 . Appearance Unknow ', '2 . Density（g/mL, 20 ℃ ）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）167 ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC 05 mmHg）Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point（ºC）Unknow ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（kPa,25ºC）Unknow ', '12 . Saturated vapor pressure（kPa,60ºC）Unknow ', '13 . Combustion heat（KJ/mol）Unknow ', '14 . Critical temperature（ºC）Unknow ', '15 . Critical pressure（KPa）Unknow ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient Unknow ', '17 . Upper limit of explosion（%,V/V）Unknow ', '18 . Lower limit of explosion（%,V/V）Unknow ', '19 . Solubility Unknow']
Exact_Mass:	442.04000