Basic information
- CAS
54624-23-6- Standard SMILES
CCC(C)=C1C(Cl)=C(Cl)C(Cl)=C1Cl- InChIKey
DWOAQDIGGQNIPG-UHFFFAOYSA-N- Molecular formula
- C9H8Cl4
- Average molar mass
- 258 g/mol
- Monoisotopic mass
- 255.938011
Names & identifiers
- Preferred name
- 5-(Butan-2-ylidene)-1,2,3,4-tetrachlorocyclopenta-1,3-diene
- IUPAC
- 5-butan-2-ylidene-1,2,3,4-tetrachlorocyclopenta-1,3-diene
Names & synonyms
54624-23-6DTXSID507880485-(Butan-2-ylidene)-1,2,3,4-tetrachlorocyclopenta-1,3-diene
Database identifiers
- CAS
54624-23-6- PubChem CID
- 71364584
- DTXSID
DTXSID50788048
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 308
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…