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4-[3,5-BIS(TRIFLUOROMETHYL)PHENYL]-3-THIOSEMICARBAZIDE

Catalog No: FT-0617350

CAS No: 38901-31-4

Chemical Name: 4-[3,5-BIS(TRIFLUOROMETHYL)PHENYL]-3-THIOSEMICARBAZIDE
Molecular Formula: C9H7F6N3S
Molecular Weight: 303.23 g/mol
InChI Key: NCYLHRNUKHCMDE-UHFFFAOYSA-N
InChI: InChI=1S/C9H7F6N3S/c10-8(11,12)4-1-5(9(13,14)15)3-6(2-4)17-7(19)18-16/h1-3H,16H2,(H2,17,18,19)

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:	4-[3,5-Di(trifluoromethyl)phenyl]-3-thiosemicarbazide
Flash_Point:	114ºC
Melting_Point:	158-160°C
FW:	303.22700
Density:	1.567g/cm3
CAS:	38901-31-4
Bolling_Point:	264.8ºC at 760mmHg
MF:	C9H7F6N3S

LogP:	4.04850
Flash_Point:	114ºC
FW:	303.22700
Density:	1.567g/cm3
Bolling_Point:	264.8ºC at 760mmHg
Computational_Chemistry:	['1. XlogP :25 ', '2. Hydrogen Bond Donor Count :3 ', '3. Hydrogen Bond Acceptor Count :8 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :3 ', '6. TPSA 822 ', '7. Heavy Atom Count :19 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :307 ', '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']
Melting_Point:	158-160°C
PSA:	82.17000
MF:	C9H7F6N3S
More_Info:	['1 . Appearance Unknow ', '2 . Density（g/mL,20 ºC）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1） Unknow ', '4 . Melting point（ºC）158-160 ', '5 . Boiling point（ºC）Unknow ', '6 . Boiling point（ºC,16mm hg）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:	303.02600