4,6-Dibenzyl-3,4,5-trichloro-3,4-dihydro-2H-pyran-2-one
Basic information
- CAS
62827-22-9- Standard SMILES
O=C1OC(Cc2ccccc2)=C(Cl)C(Cl)(Cc2ccccc2)C1Cl- InChIKey
SGHAQHANJHXYPJ-UHFFFAOYSA-N- Molecular formula
- C19H15Cl3O2
- Average molar mass
- 381.7 g/mol
- Monoisotopic mass
- 380.013763
Names & identifiers
- Preferred name
- 4,6-Dibenzyl-3,4,5-trichloro-3,4-dihydro-2H-pyran-2-one
- IUPAC
- 4,6-dibenzyl-3,4,5-trichloro-3H-pyran-2-one
Names & synonyms
62827-22-94,6-Dibenzyl-3,4,5-trichloro-3,4-dihydro-2H-pyran-2-oneNSC294169NSC 2941694,6-dibenzyl-3,4,5-trichloro-3H-pyran-2-oneDTXSID10978529NSC-294169
Database identifiers
- CAS
62827-22-9- PubChem CID
- 325432
- DTXSID
DTXSID10978529
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 493
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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