Methyl 4-[(1H-1,2,4-triazol-3-ylsulfanyl)methyl]-phenyl ether

Catalog No: FT-0680129

CAS No: 17357-75-4

Chemical Name: Methyl 4-[(1H-1,2,4-triazol-3-ylsulfanyl)methyl]-phenyl ether
Molecular Formula: C10H11N3OS
Molecular Weight: 221.28
InChI Key: KFYAPEBBSZVGIF-UHFFFAOYSA-N
InChI: InChI=1S/C10H11N3OS/c1-14-9-4-2-8(3-5-9)6-15-10-11-7-12-13-10/h2-5,7H,6H2,1H3,(H,11,12,13)

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:	5-[(4-methoxyphenyl)methylsulfanyl]-1H-1,2,4-triazole
Flash_Point:	213.2ºC
Melting_Point:	85-87ºC
FW:	221.27900
Density:	1.31g/cm3
CAS:	17357-75-4
Bolling_Point:	428.9ºC at 760mmHg
MF:	C10H11N3OS

Molecular_Structure:	['1 . Molar refractive index 5999 ', '2 . Molar volume （m3/mol）1685 ', '3 . Parachor （902K）4809 ', '4 . Surface tension 662 ', '5 . Polarizability 2378']
Flash_Point:	213.2ºC
Refractive_Index:	1.63
FW:	221.27900
Density:	1.31g/cm3
Bolling_Point:	428.9ºC at 760mmHg
Computational_Chemistry:	['1. XlogP :23 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :4 ', '4. Rotatable Bond Count :4 ', '5. Isotope Atom Count :3 ', '6. TPSA 761 ', '7. Heavy Atom Count :15 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :186 ', '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:	2.10560
Melting_Point:	85-87ºC
PSA:	76.10000
MF:	C10H11N3OS
More_Info:	['1 . Appearance 不确定 ', '2 . Density（g/mL,25/4℃）不确定 ', '3 . Relative vapor density（g/mL,Atmosphere =1）不确定 ', '4 . Melting point（ºC）不确定 ', '5 . Boiling point（ºC,Atmospheric pressure）不确定 ', '6 . Boiling point（ºC, 52kPa）不确定 ', '7 . Refractive index不确定 ', '8 . Flash point（ºC）不确定 ', '9 . Specific rotation（º）不确定 ', '10 . Spontaneous ignition point or ignition temperature（ºC）不确定 ', '11 . Vapor pressure（kPa,25ºC）不确定 ', '12 . Saturated vapor pressure（kPa,60ºC）不确定 ', '13 . Combustion heat（KJ/mol）不确定 ', '14 . Critical temperature（ºC）不确定 ', '15 . Critical pressure（KPa）不确定 ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient 不确定 ', '17 . Upper limit of explosion（%,V/V）不确定 ', '18 . Lower limit of explosion（%,V/V）不确定 ', '19 . Solubility 不确定']
Vapor_Pressure:	1.46E-07mmHg at 25°C
Exact_Mass:	221.06200