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Diethylene glycol dimethanesulfonate

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Name

Diethylene glycol dimethanesulfonate

EINECS N/A
CAS No. 34604-52-9 Density 1.389 g/cm3
PSA 112.73000 LogP 1.11700
Solubility N/A Melting Point 57-58 °C
Formula C6H14O7S2 Boiling Point 480.2 °C at 760 mmHg
Molecular Weight 262.305 Flash Point 244.2 °C
Transport Information N/A Appearance White Solid
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 34604-52-9 (Ethanol, 2,2'-oxybis-, 1,1'-dimethanesulfonate) Hazard Symbols N/A
Synonyms

Ethanol, 2,2-oxybis-, dimethanesulfonate;Oxydiethane-2,1-diyl dimethanesulfonate;

 

Diethylene glycol dimethanesulfonate Specification

The Ethanol, 2,2'-oxybis-, 1,1'-dimethanesulfonate, with the CAS registry number 34604-52-9, is also known as Ethanol, 2,2-oxybis-, dimethanesulfonate. It belongs to the product categories of Aliphatics; Intermediates; Sulfur & Selenium Compounds. This chemical's molecular formula is C6H14O7S2 and molecular weight is 262.30. What's more, its systematic name is oxydiethane-2,1-diyl dimethanesulfonate. It is used as an intermediate in the production of alkylating agents.

Physical properties of Ethanol, 2,2'-oxybis-, 1,1'-dimethanesulfonate are: (1)ACD/LogP: -1.03; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.03; (4)ACD/LogD (pH 7.4): -1.03; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 6.56; (8)ACD/KOC (pH 7.4): 6.56; (9)#H bond acceptors: 7; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 8; (12)Polar Surface Area: 112.73 Å2; (13)Index of Refraction: 1.47; (14)Molar Refractivity: 52.68 cm3; (15)Molar Volume: 188.7 cm3; (16)Polarizability: 20.88×10-24cm3; (17)Surface Tension: 47.7 dyne/cm; (18)Density: 1.389 g/cm3; (19)Flash Point: 244.2 °C; (20)Enthalpy of Vaporization: 71.62 kJ/mol; (21)Boiling Point: 480.2 °C at 760 mmHg; (22)Vapour Pressure: 6.46E-09 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=S(=O)(OCCOCCOS(=O)(=O)C)C
(2)Std. InChI: InChI=1S/C6H14O7S2/c1-14(7,8)12-5-3-11-4-6-13-15(2,9)10/h3-6H2,1-2H3
(3)Std. InChIKey: CEGQKEWSEGCYRS-UHFFFAOYSA-N

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