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1-(1,3-Dithiolan-2-yl)butane-1,2,3,4-tetrol

HCID 301047
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Basic information

CAS
43179-54-0
Standard SMILES
OCC(O)C(O)C(O)C1SCCS1
InChIKey
IRFFAFMANFPRHF-UHFFFAOYSA-N
Molecular formula
C7H14O4S2
Average molar mass
226.3 g/mol
Monoisotopic mass
226.03335127

Names & identifiers

Preferred name
1-(1,3-Dithiolan-2-yl)butane-1,2,3,4-tetrol
IUPAC
1-(1,3-dithiolan-2-yl)butane-1,2,3,4-tetrol

Names & synonyms

1-(1,3-dithiolan-2-yl)butane-1,2,3,4-tetrol43179-54-0D-Arabinose, cyclic ethylene mercaptalD-Arabinose ethylenedithioacetalDTXSID50306504IRFFAFMANFPRHF-UHFFFAOYSA-NNSC176979NSC-176979D-Arabinose, cyclic 1,2-ethanediyl mercaptalD-Ribose, cyclic 1,2-ethanediyl dithioacetal (9CI)

Database identifiers

CAS
43179-54-0
PubChem CID
301047
DTXSID
DTXSID50306504

Properties

Computed structural properties

XLogP
-1.1
Topological polar surface area
132 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
6
Rotatable bonds
4
Heavy atoms
13
Formal charge
0
Complexity
151

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Compound notes

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