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CAS No.: | 22317-89-1 |
---|---|
Name: | (METHYLSULFONYL)METHANESULFONYL CHLORIDE |
Article Data: | 2 |
Molecular Structure: | |
Formula: | C2H5ClO4S2 |
Molecular Weight: | 192.644 |
Synonyms: | Methylsulfonyl-methanesulfonyl chloride; |
Density: | 1.675 g/cm3 |
Melting Point: | 109 °C |
Boiling Point: | 379.8 °C at 760 mmHg |
Flash Point: | 183.5 °C |
Solubility: | Soluble in water (50g/L). |
Hazard Symbols: | CT |
Risk Codes: | 34 |
Safety: | 26-36/37/39 |
PSA: | 85.04000 |
LogP: | 1.71870 |
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The Methanesulfonylchloride, 1-(methylsulfonyl)-, with the CAS registry number of 22317-89-1, is also known as Methylsulfonyl-methanesulfonyl chloride. This chemical's molecular formula is C2H5ClO4S2 and molecular weight is 192.64. What's more, its systematic name is (Methylsulfonyl)methanesulfonyl chloride. In addition, it must be stored in airtight containers and placed in a dry, cool place.
Physical properties about the Methanesulfonylchloride, 1-(methylsulfonyl)- are: (1)ACD/LogP: -0.71; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.7; (4)ACD/LogD (pH 7.4): -0.7; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 9.86; (8)ACD/KOC (pH 7.4): 9.86; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 85.04 Å2; (13)Index of Refraction: 1.499; (14)Molar Refractivity: 33.76 cm3; (15)Molar Volume: 114.9 cm3; (16)Surface Tension: 57.4 dyne/cm; (17)Density: 1.675 g/cm3; (18)Flash Point: 183.5 °C; (19)Enthalpy of Vaporization: 60.33 kJ/mol; (20)Boiling Point: 379.8 °C at 760 mmHg; (21)Vapour Pressure: 1.24E-05 mmHg at 25 °C.
When you are using this chemical, please be cautious about it as the following:
As a chemical, it may cause burns. If contact with eyes accidently, rinse immediately with plenty of water and seek medical advice. In addition, during using it, wear suitable protective clothing, gloves and eye/face protection.
You can still convert the following datas into molecular structure:
(1) SMILES: O=S(=O)(C)CS(Cl)(=O)=O
(2) InChI: InChI=1/C2H5ClO4S2/c1-8(4,5)2-9(3,6)7/h2H2,1H3
(3) InChIKey: DQDYGBSUPOHHMW-UHFFFAOYAT