Chemical Name: Brassinin
Molecular Formula: C11H12N2S2
Molecular Weight: 236.4
InChI Key: QYKQWFZDEDFELK-UHFFFAOYSA-N
InChI: InChI=1S/C11H12N2S2/c1-15-11(14)13-7-8-6-12-10-5-3-2-4-9(8)10/h2-6,12H,7H2,1H3,(H,13,14)

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

Molecular_Structure:	['1. Molar refractive index 7159 ', '2. Molar volume 1789 ', '3. Parachor （902K）5122 ', '4. Surface tension 671 ', '5. Dielectric constant N/A ', '6. Polarizability 2838 ', '7. Single isotope mass 236044188 Da ', '8. Nominal mass 236 Da ', '9. Average mass 2363564 Da']
LogP:	2.74
Flash_Point:	218.0±29.3 °C
Refractive_Index:	1.732
FW:	236.356
Density:	1.3±0.1 g/cm3
Bolling_Point:	436.9±47.0 °C at 760 mmHg
Computational_Chemistry:	['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :2 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :2 ', '6. TPSA 852 ', '7. Heavy Atom Count :15 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :233 ', '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:	132-133ºC
PSA:	85.21000
MF:	C11H12N2S2
Vapor_Pressure:	0.0±1.0 mmHg at 25°C
Exact_Mass:	236.044189