Basic information
- CAS
26322-41-8- Standard SMILES
COC1(OC)C2(Cl)C(Cl)=C(Cl)C1(Cl)C1(Cl)C(Cl)=C(Cl)C(=O)C21Cl- InChIKey
VIWDWEHVBQLRMO-UHFFFAOYSA-N- Molecular formula
- C12H6Cl8O3
- Average molar mass
- 481.8 g/mol
- Monoisotopic mass
- 477.782516
Names & identifiers
- Preferred name
- 1,2,4,5,6,7,8,9-Octachloro-10,10-dimethoxytricyclo[5.2.1.02,6]deca-4,8-dien-3-one
- IUPAC
- 1,2,4,5,6,7,8,9-octachloro-10,10-dimethoxytricyclo[5.2.1.02,6]deca-4,8-dien-3-one
Names & synonyms
NSC13496226322-41-8DTXSID40329580NSC-1349622,3,3a,4,5,6,7,7a-Octachloro-8,8-dimethoxy-3a,4,7,7a-tetrahydro-1H-4,7-methanoinden-1-one
Database identifiers
- CAS
26322-41-8- PubChem CID
- 421504
- DTXSID
DTXSID40329580- Nikkaji
- J213.713E
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 715
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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