Name: 1-(ISOCYANOMETHYL)-1H-BENZOTRIAZOLE
Brand: FINETECH INDUSTRY LIMITED
SKU: FT-0642060
Availability: InStock
Rating: 4.5 (11 reviews)

Catalog No: FT-0642060

CAS No: 87022-42-2

Chemical Name: 1-(ISOCYANOMETHYL)-1H-BENZOTRIAZOLE
Molecular Formula: C8H6N4
Molecular Weight: 158.16
InChI Key: YZTNZXMSOPEFKC-UHFFFAOYSA-N
InChI: InChI=1S/C8H6N4/c1-9-6-12-8-5-3-2-4-7(8)10-11-12/h2-5H,6H2

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:	1-(isocyanomethyl)benzotriazole
Flash_Point:	N/A
Melting_Point:	80-84ºC(lit.)
FW:	158.16000
Density:	N/A
CAS:	87022-42-2
Bolling_Point:	N/A
MF:	C8H6N4

Computational_Chemistry:	['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :N/A ', '6. TPSA 351 ', '7. Heavy Atom Count :12 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :206 ', '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:	0.53880
MF:	C8H6N4
Melting_Point:	80-84ºC(lit.)
FW:	158.16000
PSA:	30.71000
More_Info:	['1 . Appearance 粉末 ', '2 . Density（g/mL25 ºC）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）82 ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC4mmHg）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（Pa,25）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（正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:	158.05900