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Hexasulfan

CAT: 1596-AR-H01120-06Size: 250 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-H01120-06Size:250 Units
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CAS Number
4239-24-1
Synonyms
Hexane-1,6-diyldimethanesulfonate; Methanesulfonic Acid Hexamethylene Ester; 1,6-Hexamethylene Dimesylate; 6-Methylsulfonyloxyhexyl Methylsulfonate; Hexasulfan; Hexasulphan; 1,6-Hexanediol Dimethanesulfonate;1,6-Bis (mesyloxy) hexane
Molecular Formula
C8H18O6S2
Molecular Weight
274.36
API Name
Hexasulfan

Chemical Information

1,6-Hexanediol, dimethanesulfonate
CAS Number4239-24-1
PubChem CID145735
IUPAC Name6-methylsulfonyloxyhexyl methanesulfonate
Molecular FormulaC8H18O6S2
Molecular Weight274.4
XLogP0.2
Topological Polar Surface Area104
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count9
Heavy Atom Count16
Formal Charge0
Complexity320
SMILES
CS(=O)(=O)OCCCCCCOS(=O)(=O)C
InChI
InChI=1S/C8H18O6S2/c1-15(9,10)13-7-5-3-4-6-8-14-16(2,11)12/h3-8H2,1-2H3
InChIKey
WZOJEWBBWCYINS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1,6-Hexanediol, dimethanesulfonate
CAS: 4239-24-1
CID: 145735
Formula: C8H18O6S2
MW: 274.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight274.4
XLogP30.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count9
Exact Mass274.05448064
Monoisotopic Mass274.05448064
Topological Polar Surface Area104 Ų
Heavy Atom Count16
Formal Charge0
Complexity320
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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CatalogName
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