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15886-83-6

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Basic Information
CAS No.: 15886-83-6
Name: octane-1,8-diyl dimethanesulfonate
Article Data: 2
Molecular Structure:
Molecular Structure of 15886-83-6 (octane-1,8-diyl dimethanesulfonate)
Formula: C10H22 O6 S2
Molecular Weight: 302.413
Synonyms: 1,8-Octanediol,dimethanesulfonate (7CI,8CI,9CI);Methanesulfonic acid, octamethylene ester(6CI);NSC 176051;Octasulphan;Octasulfan;
Density: 1.217g/cm3
Boiling Point: 489.9°C at 760 mmHg
Flash Point: 250.1°C
Safety: Mutation data reported. When heated to decomposition it emits toxic vapors of SOx.
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Chemistry

IUPAC Name: 8-Methylsulfonyloxyoctyl methanesulfonate
Synonyms of Octane dimethanesulphonate (CAS NO.15886-83-6): Octasulfan ; Octasulphan ; 1,8-Octanediol, dimethanesulfonate
InChI: InChI=1/C10H22O6S2/c1-17(11,12)15-9-7-5-3-4-6-8-10-16-18(2,13)14/h3-10H2,1-2H3 Copy
InChIKey: ZMIHCVPWXMOTIF-UHFFFAOYAA
CAS NO: 15886-83-6
Molecular Formula: C10H22O6S2
Molecular Weight: 302.4081
Molecular Structure :
H bond acceptors: 6
H bond donors: 0
Freely Rotating Bonds: 11
Polar Surface Area: 103.5 Å2
Index of Refraction: 1.471
Molar Refractivity: 69.46 cm3
Molar Volume: 248.3 cm3
Surface Tension: 42.9 dyne/cm
Density: 1.217 g/cm3
Flash Point: 250.1 °C
Enthalpy of Vaporization: 72.76 kJ/mol
Boiling Point: 489.9 °C at 760 mmHg
Vapour Pressure: 2.87E-09 mmHg at 25°C

Toxicity Data With Reference

1.    

dnd-rat-oth 250 µmol/L

     BCPCA6    Biochemical Pharmacology. 32 (1983),2297.

Safety Profile

Mutation data reported. When Octane dimethanesulphonate (CAS NO.15886-83-6) is heated to decomposition, it emits toxic vapors of SOx.