Basic information
- CAS
7338-38-7- Standard SMILES
O=C1C(Br)=CC(=C2C=C(Br)C(=O)C(Br)=C2)C=C1Br- InChIKey
MPRSKYSFMYIXCU-UHFFFAOYSA-N- Molecular formula
- C12H4Br4O2
- Average molar mass
- 499.77 g/mol
- Monoisotopic mass
- 495.69448
Names & identifiers
- Preferred name
- 3,3',5,5'-Tetrabromo-1,1'-bi(cyclohexa-2,5-dien-1-ylidene)-4,4'-dione
- IUPAC
- 2,6-dibromo-4-(3,5-dibromo-4-oxocyclohexa-2,5-dien-1-ylidene)cyclohexa-2,5-dien-1-one
Names & synonyms
7338-38-73,3',5,5'-tetrabromo-1,1'-bi(cyclohexa-2,5-dien-1-ylidene)-4,4'-dioneDTXSID30303091RefChem:269811DTXCID60254224NSC156583NSC-1565833,3',5,5'-Tetrabromo[1,1'-bi(cyclohexa-2,5-dien-1-ylidene)]-4,4'-dione
Database identifiers
- CAS
7338-38-7- PubChem CID
- 291381
- DTXSID
DTXSID30303091
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 34.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 516
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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