O-(6-methoxy-2,2-dimethyl-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-7-yl) methylsulfanylmethanethioate
Basic information
- CAS
64429-69-2- Standard SMILES
COC1OCC2OC(C)(C)OC2C1OC(=S)SC- InChIKey
DSOIYSHTYHMDGW-UHFFFAOYSA-N- Molecular formula
- C11H18O5S2
- Average molar mass
- 294.4 g/mol
- Monoisotopic mass
- 294.05956602
Names & identifiers
- Preferred name
- O-(6-methoxy-2,2-dimethyl-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-7-yl) methylsulfanylmethanethioate
- IUPAC
- O-(6-methoxy-2,2-dimethyl-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-7-yl) methylsulfanylmethanethioate
Names & synonyms
64429-69-2NSC25267O-(6-methoxy-2,2-dimethyl-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-7-yl) methylsulfanylmethanethioateDTXSID10328404NSC-25267Methyl 3,4-O-(1-methylethylidene)-2-O-[(methylsulfanyl)carbonothioyl]pentopyranoside
Database identifiers
- CAS
64429-69-2- PubChem CID
- 409935
- DTXSID
DTXSID10328404
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 323
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Related reactions
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Compound notes
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