Basic information
- CAS
18554-41-1- Standard SMILES
CC1(C2(C)SCCS2)SCCS1- InChIKey
QLCLJCGLGIOPPD-UHFFFAOYSA-N- Molecular formula
- C8H14S4
- Average molar mass
- 238.5 g/mol
- Monoisotopic mass
- 237.99783514
Names & identifiers
- Preferred name
- 2,2'-Dimethyl-2,2'-bi-1,3-dithiolane
- IUPAC
- 2-methyl-2-(2-methyl-1,3-dithiolan-2-yl)-1,3-dithiolane
Names & synonyms
NSC13284618554-41-12,2'-dimethyl-2,2'-bi-1,3-dithiolaneDTXSID10299781NSC-132846
Database identifiers
- CAS
18554-41-1- PubChem CID
- 280720
- DTXSID
DTXSID10299781- Nikkaji
- J1.845.946I
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 148
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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