2,4,4,6-Tetramethyl-3,5-dithiaheptane
Basic information
- CAS
4141-76-8- Standard SMILES
CC(C)SC(C)(C)SC(C)C- InChIKey
XDSAVWGEUYYYGM-UHFFFAOYSA-N- Molecular formula
- C9H20S2
- Average molar mass
- 192.4 g/mol
- Monoisotopic mass
- 192.10064299
Names & identifiers
- Preferred name
- 2,4,4,6-Tetramethyl-3,5-dithiaheptane
- IUPAC
- 2,2-bis(propan-2-ylsulfanyl)propane
Names & synonyms
2,4,4,6-tetramethyl-3,5-dithiaheptane4141-76-8DTXSID00335480RefChem:245491DTXCID00286569XDSAVWGEUYYYGM-UHFFFAOYSA-N2,2-Bis[(propan-2-yl)sulfanyl]propane
Database identifiers
- CAS
4141-76-8- PubChem CID
- 525367
- DTXSID
DTXSID00335480
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 50.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 94.1
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Compound notes
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