Basic information
- CAS
69796-48-1- Standard SMILES
O=C1CC2(CC3(Cl)C(Cl)=C(Cl)C2(Cl)C3(Cl)Cl)C(=O)O1- InChIKey
MCPBDEMKBSKYSO-UHFFFAOYSA-N- Molecular formula
- C10H4Cl6O3
- Average molar mass
- 384.8 g/mol
- Monoisotopic mass
- 381.82916
Names & identifiers
- Preferred name
- 1,2,3,4,7,7-Hexachlorospiro[bicyclo[2.2.1]hept-2-ene-5,3'-oxolane]-2',5'-dione
- IUPAC
- 1,2,3,4,7,7-hexachlorospiro[bicyclo[2.2.1]hept-2-ene-5,3'-oxolane]-2',5'-dione
Names & synonyms
69796-48-1NSC383201,2,3,4,7,7-hexachlorospiro[bicyclo[2.2.1]hept-2-ene-5,3'-oxolane]-2',5'-dioneDTXSID20328591NSC-383201,2,3,4,7,7-hexachlorospiro[bicyclo[2.2.1]hept-2-ene-5,3'-tetrahydrofuran]-2',5'-dione1,4,5,6,7,7-Hexachlorospiro[bicyclo[2.2.1]hept-5-ene-2,3'-oxolane]-2',5'-dioneBicyclo[2.2.1]hept-5-ene-2-acetic acid,4,5,6,7,7-hexachloro-, cyclic anhydrideSpiro[bicyclo[2.2.1]hept-5-ene-2,5'(4'H)-dione, 1,4,5,6,7,7-hexachloro-Bicyclo[2.2.1]hept-5-ene-2-acetic acid, 2-carboxy-1,4,5,6,7,7-hexachloro-,cyclic anhydride
Database identifiers
- CAS
69796-48-1- PubChem CID
- 412252
- DTXSID
DTXSID20328591
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 43.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 572
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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