2-NITRODIBENZOTHIOPHENE

Catalog No: FT-0636219

CAS No: 6639-36-7

Chemical Name: 2-NITRODIBENZOTHIOPHENE
Molecular Formula: C12H7NO2S
Molecular Weight: 229.26
InChI Key: GXLYVLHWXVRVKI-UHFFFAOYSA-N
InChI: InChI=1S/C12H7NO2S/c14-13(15)8-5-6-12-10(7-8)9-3-1-2-4-11(9)16-12/h1-7H

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

Exact_Mass:	229.02000
Refractive_Index:	1.782
LogP:	4.48590
Bolling_Point:	422.5ºC at 760 mmHg
Density:	1.441g/cm3
MF:	C12H7NO2S
Computational_Chemistry:	['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :N/A ', '6. TPSA 741 ', '7. Heavy Atom Count :16 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :291 ', '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:	74.06000
Melting_Point:	186ºC
Flash_Point:	209.3ºC
FW:	229.25400