Chemical Name: DIETHYL (BENZOTRIAZOL-1-YL)IMINOMALONATE
Molecular Formula: C13H14N4O4
Molecular Weight: 290.27
InChI Key: HQLKNISWSLQKRF-UHFFFAOYSA-N
InChI: InChI=1S/C13H14N4O4/c1-3-20-12(18)11(13(19)21-4-2)15-17-10-8-6-5-7-9(10)14-16-17/h5-8H,3-4H2,1-2H3

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:	diethyl 2-(benzotriazol-1-ylimino)propanedioate
Flash_Point:	203.6ºC
Melting_Point:	99-100ºC
FW:	290.27500
Density:	1.34g/cm3
CAS:	100796-79-0
Bolling_Point:	413ºC at 760mmHg
MF:	C13H14N4O4

Molecular_Structure:	['1. Molar refractive index 7458 ', '2. Molar volume 2156 ', '3. Parachor （902K）5747 ', '4. Surface tension 504 ', '5. Dielectric constant N/A ', '6. Polarizability 2956 ', '7. Single isotope mass 290101505 Da ', '8. Nominal mass 290 Da ', '9. Average mass 2902747 Da']
Flash_Point:	203.6ºC
Refractive_Index:	1.608
FW:	290.27500
Density:	1.34g/cm3
Bolling_Point:	413ºC at 760mmHg
Computational_Chemistry:	['1. XlogP :25 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :7 ', '4. Rotatable Bond Count :7 ', '5. Isotope Atom Count :N/A ', '6. TPSA 957 ', '7. Heavy Atom Count :21 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :406 ', '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:	0.76160
Melting_Point:	99-100ºC
PSA:	95.67000
MF:	C13H14N4O4
Vapor_Pressure:	4.97E-07mmHg at 25°C
Exact_Mass:	290.10200