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6,7,8-Trimethoxy-4,4a,6,7,8,8a-hexahydropyrano[2,3-e][1,3]oxathiine-2-thione

HCID 302249
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Basic information

CAS
35905-06-7
Standard SMILES
COC1OC2CSC(=S)OC2C(OC)C1OC
InChIKey
CUMAFERJQCQEFW-UHFFFAOYSA-N
Molecular formula
C10H16O5S2
Average molar mass
280.4 g/mol
Monoisotopic mass
280.04391595

Names & identifiers

Preferred name
6,7,8-Trimethoxy-4,4a,6,7,8,8a-hexahydropyrano[2,3-e][1,3]oxathiine-2-thione
IUPAC
6,7,8-trimethoxy-4,4a,6,7,8,8a-hexahydropyrano[2,3-e][1,3]oxathiine-2-thione

Names & synonyms

35905-06-7NSC185329DTXSID50307011NSC-1853296,7,8-Trimethoxyhexahydro-2H-pyrano[2,3-e][1,3]oxathiine-2-thione

Database identifiers

CAS
35905-06-7
PubChem CID
302249
DTXSID
DTXSID50307011

Properties

Computed structural properties

XLogP
1
Topological polar surface area
104 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
7
Rotatable bonds
3
Heavy atoms
17
Formal charge
0
Complexity
288

Related reactions

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Compound notes

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