2,2'-Methanediylbis(2-methyl-1,3-dithiane)
Basic information
- CAS
19451-24-2- Standard SMILES
CC1(CC2(C)SCCCS2)SCCCS1- InChIKey
JQPXNRRMZOHAJR-UHFFFAOYSA-N- Molecular formula
- C11H20S4
- Average molar mass
- 280.5 g/mol
- Monoisotopic mass
- 280.04478533
Names & identifiers
- Preferred name
- 2,2'-Methanediylbis(2-methyl-1,3-dithiane)
- IUPAC
- 2-methyl-2-[(2-methyl-1,3-dithian-2-yl)methyl]-1,3-dithiane
Names & synonyms
19451-24-22,2'-methanediylbis(2-methyl-1,3-dithiane)NSC132851DTXSID30299783NSC-1328512,2'-Methylenebis(2-methyl-1,3-dithiane)
Database identifiers
- CAS
19451-24-2- PubChem CID
- 280723
- DTXSID
DTXSID30299783
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 183
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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