2,9-Dibromo-4,7-dioxadispiro[4.0.4^{6}.2^{5}]dodeca-1,9-diene-3,8-dione
Basic information
- CAS
61597-48-6- Standard SMILES
O=C1OC2(C=C1Br)CCC21C=C(Br)C(=O)O1- InChIKey
BBBOVLHJABENFR-UHFFFAOYSA-N- Molecular formula
- C10H6Br2O4
- Average molar mass
- 349.96 g/mol
- Monoisotopic mass
- 347.86328
Names & identifiers
- Preferred name
- 2,9-Dibromo-4,7-dioxadispiro[4.0.4^{6}.2^{5}]dodeca-1,9-diene-3,8-dione
- IUPAC
- 2,9-dibromo-4,7-dioxadispiro[4.0.46.25]dodeca-1,9-diene-3,8-dione
Names & synonyms
61597-48-6NSC2644532,9-dibromo-4,7-dioxadispiro[4.0.4^{6}.2^{5}]dodeca-1,9-diene-3,8-dioneDTXSID40312937NSC-2644533,9-Dibromo-1,7-dioxadispiro[4.0.4~6~.2~5~]dodeca-3,9-diene-2,8-dione
Database identifiers
- CAS
61597-48-6- PubChem CID
- 319693
- DTXSID
DTXSID40312937
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 437
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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