N-BUTYL METHYL SULFIDE

Catalog No: FT-0654652

CAS No: 628-29-5

Chemical Name: N-BUTYL METHYL SULFIDE
Molecular Formula: C5H12S
Molecular Weight: 104.22
InChI Key: WCXXISMIJBRDQK-UHFFFAOYSA-N
InChI: InChI=1S/C5H12S/c1-3-4-5-6-2/h3-5H2,1-2H3

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

Melting_Point:	N/A
CAS:	628-29-5
MF:	C5H12S
Flash_Point:	20.6±10.3 °C
Product_Name:	2-thiahexane
Density:	0.8±0.1 g/cm3
FW:	104.214
Bolling_Point:	122.6±3.0 °C at 760 mmHg

Refractive_Index:	1.444
Vapor_Pressure:	16.6±0.2 mmHg at 25°C
Flash_Point:	20.6±10.3 °C
LogP:	2.48
Bolling_Point:	122.6±3.0 °C at 760 mmHg
FW:	104.214
PSA:	25.30000
Computational_Chemistry:	['1. XlogP :21 ', '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 :6 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :199 ', '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']
MF:	C5H12S
Exact_Mass:	104.065971
Molecular_Structure:	['1 . Molar refractive index 3321 ', '2 . Molar volume 1250 ', '3 . Parachor （902K）2817 ', '4 . Surface tension 257 ', '5 . Polarizability 1316']
Density:	0.8±0.1 g/cm3
More_Info:	['1 . Appearance Colourless Liquid 。 ', '2 . Density（g/mL,20/4℃）08429 ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）-97 ', '5 . Boiling point（ºC,Atmospheric pressure）122-123 ', '6 . Boiling point（ºC,52kPa）Unknow ', '7. Refractive index (n20D) 14477 ', '8 . Flash point（ºC）20 ', '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 Insoluble in Water 。']