3,4-Dichloro-6,7-dimethyl-2H-1-benzopyran-2-one
Basic information
- CAS
35794-98-0- Standard SMILES
Cc1cc2oc(=O)c(Cl)c(Cl)c2cc1C- InChIKey
OVDYYUGIHUIEOV-UHFFFAOYSA-N- Molecular formula
- C11H8Cl2O2
- Average molar mass
- 243.08 g/mol
- Monoisotopic mass
- 241.9901349
Names & identifiers
- Preferred name
- 3,4-Dichloro-6,7-dimethyl-2H-1-benzopyran-2-one
- IUPAC
- 3,4-dichloro-6,7-dimethylchromen-2-one
Names & synonyms
35794-98-03,4-Dichloro-6,7-dimethyl-2H-1-benzopyran-2-oneDTXSID50494617
Database identifiers
- CAS
35794-98-0- PubChem CID
- 12367474
- DTXSID
DTXSID50494617
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 325
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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