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PENTAFLUOROPHENYL ISOTHIOCYANATE

Catalog No: FT-0657991

CAS No: 35923-79-6

Chemical Name: PENTAFLUOROPHENYL ISOTHIOCYANATE
Molecular Formula: C7F5NS
Molecular Weight: 225.14
InChI Key: NGNKMRBGZPDABE-UHFFFAOYSA-N
InChI: InChI=1S/C7F5NS/c8-2-3(9)5(11)7(13-1-14)6(12)4(2)10

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

Melting_Point:	N/A
CAS:	35923-79-6
MF:	C7F5NS
Flash_Point:	109-110°C/35mm
Product_Name:	Pentafluorophenyl Isothiocyanate
Density:	1.594 g/mL at 20 °C(lit.)
FW:	225.13900
Bolling_Point:	38-39 °C0.2 mm Hg(lit.)

Refractive_Index:	n20/D 1.540
Flash_Point:	109-110°C/35mm
LogP:	3.11640
Bolling_Point:	38-39 °C0.2 mm Hg(lit.)
FW:	225.13900
PSA:	44.45000
Computational_Chemistry:	['1. XlogP :38 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :7 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :N/A ', '6. TPSA 444 ', '7. Heavy Atom Count :14 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :241 ', '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']
MF:	C7F5NS
Exact_Mass:	224.96700
Density:	1.594 g/mL at 20 °C(lit.)
More_Info:	['1 . Appearance Liquid ', '2 . Density（g/mL,20℃）156 ', '3 . Relative vapor density（g/mL,Atmosphere =1） Unknow ', '4 . Melting point（ºC）Unknow ', '5 . Boiling point（ºC,Atmospheric pressure） 38 -39 °C 02 mm Hg(lit) ', '6 . Boiling point（ºC,35mm hg）109-110 ', '7 . Refractive indexn20/D 1540 ', '8 . Flash point（ºC）109 -110°C / 35mm ', '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']

Hazard_Class:	6.1
Risk_Statements(EU):	R23/24/25;R34
WGK_Germany:	3
RIDADR:	UN 2206 6.1/PG 3
Hazard_Codes:	Xn: Harmful;Xi: Irritant;
HS_Code:	2930909090
Safety_Statements:	S23-S26-S36/37-S45
Packing_Group:	III