Basic information
- CAS
61685-40-3- Standard SMILES
C=CC1SCCCS1- InChIKey
SIZZLUKBSIWVMD-UHFFFAOYSA-N- Molecular formula
- C6H10S2
- Average molar mass
- 146.3 g/mol
- Monoisotopic mass
- 146.02239267
Names & identifiers
- Preferred name
- 2-Vinyl-1,3-dithiane
- IUPAC
- 2-ethenyl-1,3-dithiane
Names & synonyms
2-Vinyl-1,3-dithiane1,3-Dithiane, 2-ethenyl61685-40-3DTXSID80334810RefChem:267435DTXCID40285899SIZZLUKBSIWVMD-UHFFFAOYSA-N2-ethenyl-1,3-dithianeSCHEMBL26351668
Database identifiers
- CAS
61685-40-3- PubChem CID
- 521985
- DTXSID
DTXSID80334810- Nikkaji
- J1.033.856E
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 50.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 74.6
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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