4-Isothiocyanatobenzenesulfonamide

Catalog No: FT-0678567

CAS No: 51908-29-3

Chemical Name: 4-Isothiocyanatobenzenesulfonamide
Molecular Formula: C7H6N2O2S2
Molecular Weight: 214.3 g/mol
InChI Key: IMDUFDNFSJWYQT-UHFFFAOYSA-N
InChI: InChI=1S/C7H6N2O2S2/c8-13(10,11)7-3-1-6(2-4-7)9-5-12/h1-4H,(H2,8,10,11)

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:	208-212ºC (dec.)
CAS:	51908-29-3
MF:	C7H6N2O2S2
Flash_Point:	206.7±29.3 °C
Product_Name:	4-Isothiocyanatobenzenesulfonamide
Density:	1.5±0.1 g/cm3
FW:	214.265
Bolling_Point:	418.2±47.0 °C at 760 mmHg

Refractive_Index:	1.659
Vapor_Pressure:	0.0±1.0 mmHg at 25°C
Flash_Point:	206.7±29.3 °C
LogP:	1.81
Bolling_Point:	418.2±47.0 °C at 760 mmHg
FW:	214.265
PSA:	112.99000
Computational_Chemistry:	['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :5 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :N/A ', '6. TPSA :113 ', '7. Heavy Atom Count :13 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :306 ', '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:	208-212ºC (dec.)
MF:	C7H6N2O2S2
Exact_Mass:	213.987061
Density:	1.5±0.1 g/cm3