4,5,6,7,8,8-Hexachloro-2,3,3a,4,7,7a-hexahydro-4,7-methano-1-benzothiophene 1,1-dioxide
Basic information
- CAS
92443-00-0- Standard SMILES
O=S1(=O)CCC2C1C1(Cl)C(Cl)=C(Cl)C2(Cl)C1(Cl)Cl- InChIKey
SWIMPOZPBSOVTP-UHFFFAOYSA-N- Molecular formula
- C9H6Cl6O2S
- Average molar mass
- 390.9 g/mol
- Monoisotopic mass
- 387.821967
Names & identifiers
- Preferred name
- 4,5,6,7,8,8-Hexachloro-2,3,3a,4,7,7a-hexahydro-4,7-methano-1-benzothiophene 1,1-dioxide
- IUPAC
- 1,7,8,9,10,10-hexachloro-3λ6-thiatricyclo[5.2.1.02,6]dec-8-ene 3,3-dioxide
Names & synonyms
92443-00-0NSC1458004,5,6,7,8,8-hexachloro-2,3,3a,4,7,7a-hexahydro-4,7-methano-1-benzothiophene 1,1-dioxideDTXSID90301679NSC-1458004,5,6,7,8,8-Hexachloro-2,3,3a,4,7,7a-hexahydro-1H-4,7-methano-1lambda~6~-1-benzothiophene-1,1-dione
Database identifiers
- CAS
92443-00-0- PubChem CID
- 286722
- DTXSID
DTXSID90301679
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 42.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 578
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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