1,7,8,9,10,10-Hexachloro-4-(2-ethoxyphenyl)-4-azatricyclo[5.2.1.0~2,6~]dec-8-ene-3,5-dione
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Basic information
- CAS
497917-88-1- Standard SMILES
CCOc1ccccc1N1C(=O)C2C(C1=O)C1(Cl)C(Cl)=C(Cl)C2(Cl)C1(Cl)Cl- InChIKey
UUEFAIOTPFAUQT-UHFFFAOYSA-N- Molecular formula
- C17H11Cl6NO3
- Average molar mass
- 490 g/mol
- Monoisotopic mass
- 486.887009
Names & identifiers
- Preferred name
- 1,7,8,9,10,10-Hexachloro-4-(2-ethoxyphenyl)-4-azatricyclo[5.2.1.0~2,6~]dec-8-ene-3,5-dione
- IUPAC
- 1,7,8,9,10,10-hexachloro-4-(2-ethoxyphenyl)-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
- English name
- 1,7,8,9,10,10-hexachloro-4-(2-ethoxyphenyl)-4-azatricyclo[5.2.1.0~2,6~]dec-8-ene-3,5-dione
- Molecular formula
- C17H11Cl6NO3
- Molecular weight
- 489.99214
Names & synonyms
1,7,8,9,10,10-hexachloro-4-(2-ethoxyphenyl)-4-azatricyclo[5.2.1.0~2,6~]dec-8-ene-3,5-dioneAKOS000520926AK-968/114943821,7,8,9,10,10-hexachloro-4-(2-ethoxyphenyl)-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione4,5,6,7,8,8-hexachloro-2-(2-ethoxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Database identifiers
- CAS
497917-88-1- PubChem CID
- 3114546
Properties
Computed structural propertiesFilling in
- XLogP
- 3.9
- Topological polar surface area
- 46.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 711
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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