Molecular Formula: 247.31
Formula Weight: C13H13NO2S
Inchl Key: XIXRYMWTIKMPJU-UHFFFAOYSA-N
Inchl: InChI=1S/C13H13NO2S/c14-17(15,16)13-8-6-12(7-9-13)10-11-4-2-1-3-5-11/h1-9H,10H2,(H2,14,15,16)

Assay	Pack	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 6852 ', '2 . Molar volume 1977 ', '3 . Parachor （902K）5251 ', '4 . Surface tension 496 ', '5 . Polarizability 2716']
LogP:	2.32
Flash_Point:	209.6±29.6 °C
Refractive_Index:	1.610
FW:	247.313
Density:	1.3±0.1 g/cm3
Bolling_Point:	422.9±48.0 °C at 760 mmHg
Computational_Chemistry:	['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :N/A ', '6. TPSA 685 ', '7. Heavy Atom Count :17 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :320 ', '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']
PSA:	68.54000
MF:	C13H13NO2S
More_Info:	['1. Density（g/cm3）125 ', '2. Boiling point（760 mmHg,ºC）4229 ', '3. Flash point（ºC）2095']
Vapor_Pressure:	0.0±1.0 mmHg at 25°C
Exact_Mass:	247.066696