BENZYL PHENYL SULFIDE

Catalog No: FT-0622780

CAS No: 831-91-4

Chemical Name: BENZYL PHENYL SULFIDE
Molecular Formula: C13H12S
Molecular Weight: 200.3
InChI Key: LKMCJXXOBRCATQ-UHFFFAOYSA-N
InChI: InChI=1S/C13H12S/c1-3-7-12(8-4-1)11-14-13-9-5-2-6-10-13/h1-10H,11H2

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:	Benzyl(phenyl)sulfane
Flash_Point:	138.9±14.9 °C
Melting_Point:	40-44 °C(lit.)
FW:	200.299
Density:	1.1±0.1 g/cm3
CAS:	831-91-4
Bolling_Point:	321.1±0.0 °C at 760 mmHg
MF:	C13H12S

Molecular_Structure:	['1. Molar refractive index 6410 ', '2. Molar volume （m3/mol）1810 ', '3. Parachor （902K）4699 ', '4. Surface tension 454 ', '5. Polarizability 2541']
Flash_Point:	138.9±14.9 °C
Refractive_Index:	1.626
FW:	200.299
Density:	1.1±0.1 g/cm3
Bolling_Point:	321.1±0.0 °C at 760 mmHg
Computational_Chemistry:	['1. XlogP :39 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :N/A ', '6. TPSA 253 ', '7. Heavy Atom Count :14 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :143 ', '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:	3.80
Melting_Point:	40-44 °C(lit.)
PSA:	25.30000
MF:	C13H12S
More_Info:	['1 . Appearance Unknow ', '2 . Density（g/mL,25/4℃）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）39-42℃ ', '5 . Boiling point（ºC, 10mmHg）167-168℃/ ', '6 . Boiling point（ºC, 27mm Hg）197°C ', '7 . Refractive indexUnknow ', '8 . Flash point（ºF）>230°F ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（kPa,25ºC）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（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']
Vapor_Pressure:	0.0±0.6 mmHg at 25°C
Exact_Mass:	200.065964