1,5-Dithia-2,4,6,8-tetrazocine, 3,7-di-tert-butyl-
Basic information
- CAS
89909-08-0- Standard SMILES
CC(C)(C)C1=NSN=C(C(C)(C)C)N=S=N1- InChIKey
LLRJMGMLPDYNEM-UHFFFAOYSA-N- Molecular formula
- C10H18N4S2
- Average molar mass
- 258.4 g/mol
- Monoisotopic mass
- 258.09728894
Names & identifiers
- Preferred name
- 1,5-Dithia-2,4,6,8-tetrazocine, 3,7-di-tert-butyl-
- IUPAC
- 3,7-ditert-butyl-1λ4,5-dithia-2,4,6,8-tetrazacycloocta-1,3,6,8-tetraene
Names & synonyms
1,5-Dithia-2,4,6,8-tetrazocine, 3,7-di-tert-butyl-89909-08-0
Database identifiers
- CAS
89909-08-0- PubChem CID
- 145207
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 75.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 327
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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