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Methanesulfonic acid, nonamethylene ester (6CI)

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Name

Methanesulfonic acid, nonamethylene ester (6CI)

EINECS N/A
CAS No. 4248-77-5 Density 1.194g/cm3
PSA 103.50000 LogP 3.83110
Solubility N/A Melting Point N/A
Formula C11H24O6S2 Boiling Point 485.7°C at 760 mmHg
Molecular Weight 316.44 Flash Point 247.6°C
Transport Information N/A Appearance N/A
Safety Experimental reproductive effects. Mutation data reported. When heated to decomposition it emits toxic vapors of SOx. Risk Codes N/A
Molecular Structure Molecular Structure of 4248-77-5 (Bis(methanesulfonic acid)nonane-1,9-diyl ester) Hazard Symbols A reproductive hazard.
Synonyms

Nonasulphan;1,9-Nonandiol-dimethansulfonat;SK 7505;Nonasulfan;Methanesulfonic acid,nonamethylene ester;1,9-Nonanediol,dimethanesulfonate;CB 2067;1,9-Dimethanesulfonyloxynonane;Nonane dimethanesulphonate;Nonane-1,9-dimethanesulfonate;

Article Data 3

Methanesulfonic acid, nonamethylene ester (6CI) Chemical Properties

Molecule structure of Methanesulfonic acid, nonamethylene ester (6CI) (CAS NO.4248-77-5) :

IUPAC Name: 9-methylsulfonyloxynonyl methanesulfonate 
Molecular Weight: 316.43466 g/mol
Molecular Formula: C11H24O6S2 
Density: 1.194 g/cm3 
Boiling Point: 485.7 °C at 760 mmHg
Flash Point: 247.6 °C
Index of Refraction: 1.471
Molar Refractivity: 74.09 cm3
Molar Volume: 264.8 cm3
Polarizability: 29.37×10-24 cm3
Surface Tension: 42.2 dyne/cm 
Enthalpy of Vaporization: 72.27 kJ/mol 
Vapour Pressure: 4.08E-09 mmHg at 25 °C
XLogP3: 1.8
H-Bond Acceptor: 6
Rotatable Bond Count: 12
Exact Mass: 316.10143
MonoIsotopic Mass: 316.10143
Topological Polar Surface Area: 86.7
Heavy Atom Count: 19
Complexity: 361
Canonical SMILES: CS(=O)(=O)OCCCCCCCCCOS(=O)(=O)C
InChI: InChI=1S/C11H24O6S2/c1-18(12,13)16-10-8-6-4-3-5-7-9-11-17-19(2,14)15/h3-11H2,1-2H3
InChIKey of Methanesulfonic acid, nonamethylene ester (6CI) (CAS NO.4248-77-5) : NIYYZZQGQRDTGO-UHFFFAOYSA-N

Methanesulfonic acid, nonamethylene ester (6CI) Toxicity Data With Reference

1.    

dnd-rat-oth 250 µmol/L

    BCPCA6    Biochemical Pharmacology. 32 (1983),2297.

Methanesulfonic acid, nonamethylene ester (6CI) Safety Profile

Experimental reproductive effects. Mutation data reported. When heated to decomposition it emits toxic vapors of SOx.

Methanesulfonic acid, nonamethylene ester (6CI) Specification

 Methanesulfonic acid, nonamethylene ester (6CI) (CAS NO.4248-77-5) is also called 1,9-Di(methanesulfonoxy) nonane ; 1,9-Dimethanesulfonyloxynonane ; 1,9-Nonanediol dimethanesulfonate ; AI3-26397 ; BRN 1884323 ; CB 2067 ;
NSC 3052 ; Nonamethylene dimethanesulfonate ; Nonane dimethanesulphonate ; Nonane-1,9-dimethanesulfonate ; Nonasulfan ; Nonasulphan ; SK 7505 .

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