Basic information
- CAS
33058-12-7- Standard SMILES
OC12C3CC4C5C3C3(Cl)C(Cl)(Cl)C5(Cl)C(Cl)(C41)C23Cl- InChIKey
FWIOOTDZGJSQMX-UHFFFAOYSA-N- Molecular formula
- C12H8Cl6O
- Average molar mass
- 380.9 g/mol
- Monoisotopic mass
- 377.870631
Names & identifiers
- Preferred name
- Endrin alcohol
- IUPAC
- 1,9,10,11,11,12-hexachlorohexacyclo[5.4.1.02,6.03,10.04,8.09,12]dodecan-7-ol
- English name
- 2,2a,3,3,4,8-Hexachloro-2a,3,4,4a,5,6,6a,6b-octahydro-1,5,2,4-[1,2]ethanediylidenecyclopenta[cd]pentalen-1(2H)-ol
- Molecular formula
- C12H8Cl6O
- Molecular weight
- 380.90932
Names & synonyms
Endrin alcohol33058-12-7NSC 59452NSC 122237NSC59452NCIOpen2_007890DTXSID10865662NSC-59452NSC122237NSC-1222372,2a,3,3,4,8-Hexachloro-2a,3,4,4a,5,6,6a,6b-octahydro-1,5,2,4-[1,2]ethanediylidenecyclopenta[cd]pentalen-1(2H)-olNS00121473
Show more names
1,9,10,11,11,12-Hexachlorohexacyclo[5.4.1.0~2,6~.0~3,10~.0~4,8~.0~9,12~]dodecan-7-ol
Database identifiers
- CAS
33058-12-7- PubChem CID
- 414482
- DTXSID
DTXSID10865662- Nikkaji
- J18.160I
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 611
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…