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Galactitol, 1,6-dimethanesulfonate

HCID 97352
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Basic information

CAS
15410-53-4
Standard SMILES
CS(=O)(=O)OC[C@@H](O)[C@H](O)[C@H](O)[C@@H](O)COS(C)(=O)=O
InChIKey
ODOISJJCWUVNDJ-SOSBWXJGSA-N
Molecular formula
C8H18O10S2
Average molar mass
338.4 g/mol
Monoisotopic mass
338.03413911

Names & identifiers

Preferred name
Galactitol, 1,6-dimethanesulfonate
IUPAC
[(2R,3S,4R,5S)-2,3,4,5-tetrahydroxy-6-methylsulfonyloxyhexyl] methanesulfonate

Names & synonyms

1,6-Dimesyl-D-dulcitolNIOSH/LW5433000Dulcitol, 1,6-dimethanesulfonate, D-Galactitol, 1,6-dimethanesulfonate, D-LW54330000Galactitol, 1,6-dimethanesulfonate1,6-Bis(methanesulfonyl)dulcitol1,6-Dimethanesulfonyloxy-1,6-dideoxydulcitolNSC 117359

Database identifiers

CAS
15410-53-4
PubChem CID
97352

Properties

Computed structural properties

XLogP
-3.4
Topological polar surface area
184 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
10
Rotatable bonds
9
Heavy atoms
20
Formal charge
0
Complexity
426

Related reactions

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Compound notes

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