Basic information
- CAS
89361-81-9- Standard SMILES
O=C1OC(=O)C2C(Cl)C(Cl)C12- InChIKey
SVWYPMPUZSZFRO-UHFFFAOYSA-N- Molecular formula
- C6H4Cl2O3
- Average molar mass
- 195 g/mol
- Monoisotopic mass
- 193.9537494
Names & identifiers
- Preferred name
- 6,7-Dichloro-3-oxabicyclo[3.2.0]heptane-2,4-dione
- IUPAC
- 6,7-dichloro-3-oxabicyclo[3.2.0]heptane-2,4-dione
Names & synonyms
6,7-dichloro-3-oxabicyclo[3.2.0]heptane-2,4-dione89361-81-9NSC119081SCHEMBL1360230DTXSID90297902NSC-119081
Database identifiers
- CAS
89361-81-9- PubChem CID
- 273696
- DTXSID
DTXSID90297902- Nikkaji
- J2.821.393J
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 43.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 216
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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