Basic information
- CAS
29000-30-4- Standard SMILES
CC1OC2(OC1=O)C(Cl)=CC(=O)C=C2Cl- InChIKey
BKBCSHBUQIXDFS-UHFFFAOYSA-N- Molecular formula
- C9H6Cl2O4
- Average molar mass
- 249.04 g/mol
- Monoisotopic mass
- 247.9643141
Names & identifiers
- Preferred name
- 6,10-Dichloro-3-methyl-1,4-dioxaspiro[4.5]deca-6,9-diene-2,8-dione
- IUPAC
- 6,10-dichloro-2-methyl-1,4-dioxaspiro[4.5]deca-6,9-diene-3,8-dione
Names & synonyms
29000-30-4DTXSID104971246,10-Dichloro-3-methyl-1,4-dioxaspiro[4.5]deca-6,9-diene-2,8-dione
Database identifiers
- CAS
29000-30-4- PubChem CID
- 12413640
- DTXSID
DTXSID10497124
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 388
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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