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CAT: 0127-OR1006258-03Size: 5 gDry Ice: NoHazardous: No

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CAT#:0127-OR1006258-03Size:5 g

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

55400-73-2

Purity

95%

Smiles

CS(OCCOCCOCCOCCOS(C)(=O)=O)(=O)=O

Chemical Information

1,11-Bis(methanesulfonyloxy)-3,6,9-trioxandecane

CAS Number	55400-73-2
PubChem CID	3637875
IUPAC Name	2-[2-[2-(2-methylsulfonyloxyethoxy)ethoxy]ethoxy]ethyl methanesulfonate
Molecular Formula	C10H22O9S2
Molecular Weight	350.4
XLogP	-1.4
Topological Polar Surface Area	131
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	9
Rotatable Bond Count	14
Heavy Atom Count	21
Formal Charge	0
Complexity	390

SMILES

CS(=O)(=O)OCCOCCOCCOCCOS(=O)(=O)C

InChI

InChI=1S/C10H22O9S2/c1-20(11,12)18-9-7-16-5-3-15-4-6-17-8-10-19-21(2,13)14/h3-10H2,1-2H3

InChIKey

GKMDADHKHXRPPF-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 55400-73-2

CID: 3637875

Formula: C10H22O9S2

MW: 350.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	350.4
XLogP3	-1.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	9
Rotatable Bond Count	14
Exact Mass	350.07052462
Monoisotopic Mass	350.07052462
Topological Polar Surface Area	131 Å²
Heavy Atom Count	21
Formal Charge	0
Complexity	390
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes