FT-0608035 CAS:137049-00-4 chemical structure

1-Methyl-1H-imidazole-4-sulfonyl chloride

Name: 1-Methyl-1H-imidazole-4-sulfonyl chloride
Rating: 4.5 (11 reviews)

Catalog No: FT-0608035

CAS No: 137049-00-4

Molecular Formula: 180.61
Formula Weight: C4H5ClN2O2S
Inchl Key: KXUGUWTUFUWYRS-UHFFFAOYSA-N
Inchl: InChI=1S/C4H5ClN2O2S/c1-7-2-4(6-3-7)10(5,8)9/h2-3H,1H3

Assay	Pack	Price	Stock
98%	1g	N/A	N/A
98%	5g	N/A	N/A
98%	Bulk Quantity	N/A	N/A

Product_Name:	1-methyl-1Himidazole-4-sulfonylchloride
Flash_Point:	175.7±20.4 °C
Melting_Point:	88-91°C
FW:	180.613
Density:	1.6±0.1 g/cm3
CAS:	137049-00-4
Bolling_Point:	366.9±15.0 °C at 760 mmHg
MF:	C4H5ClN2O2S

Molecular_Structure:	['1. Molar refractive index 396 ', '2. Molar volume 1125 ', '3. Parachor （902K）3103 ', '4. Surface tension 578 ', '5. Dielectric constant N/A ', '6. Polarizability 157 ', '7. Single isotope mass 179976025 Da ', '8. Nominal mass 180 Da ', '9. Average mass 1806127 Da']
LogP:	-0.44
Flash_Point:	175.7±20.4 °C
Refractive_Index:	1.622
FW:	180.613
Density:	1.6±0.1 g/cm3
Bolling_Point:	366.9±15.0 °C at 760 mmHg
Computational_Chemistry:	['1. XlogP :04 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :N/A ', '6. TPSA 603 ', '7. Heavy Atom Count :10 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :210 ', '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']
Melting_Point:	88-91°C
PSA:	60.34000
MF:	C4H5ClN2O2S
More_Info:	['1 . Appearance Unknow ', '2 . Density（g/mL,20℃）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）88-91 ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC,KPa）Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point（ºC）Unknow ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（Pa,20ºC）Unknow ', '12 . Saturated vapor pressure（KPa,20ºC）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±0.8 mmHg at 25°C
Exact_Mass:	179.976028