6-(Dichloromethyl)-6-methyl-5-methylidene-8-phenylbicyclo[2.2.2]oct-7-ene-2,2,3,3-tetracarbonitrile
Basic information
- CAS
22242-73-5- Standard SMILES
C=C1C2C(c3ccccc3)=CC(C1(C)C(Cl)Cl)C(C#N)(C#N)C2(C#N)C#N- InChIKey
UOVBVIWMENNHPQ-UHFFFAOYSA-N- Molecular formula
- C21H14Cl2N4
- Average molar mass
- 393.3 g/mol
- Monoisotopic mass
- 392.0595519
Names & identifiers
- Preferred name
- 6-(Dichloromethyl)-6-methyl-5-methylidene-8-phenylbicyclo[2.2.2]oct-7-ene-2,2,3,3-tetracarbonitrile
- IUPAC
- 7-(dichloromethyl)-7-methyl-8-methylidene-5-phenylbicyclo[2.2.2]oct-5-ene-2,2,3,3-tetracarbonitrile
Names & synonyms
22242-73-5NSC1716666-(dichloromethyl)-6-methyl-5-methylidene-8-phenylbicyclo[2.2.2]oct-7-ene-2,2,3,3-tetracarbonitrileDTXSID20305781NSC-1716667-(Dichloromethyl)-7-methyl-8-methylidene-5-phenylbicyclo[2.2.2]oct-5-ene-2,2,3,3-tetracarbonitrile
Database identifiers
- CAS
22242-73-5- PubChem CID
- 299197
- DTXSID
DTXSID20305781
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 95.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 886
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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