Basic information
- CAS
5461-04-1- Standard SMILES
O=C1OCCC1(Br)C(Br)c1ccccc1- InChIKey
ROIKPDSNGKFMLY-UHFFFAOYSA-N- Molecular formula
- C11H10Br2O2
- Average molar mass
- 334 g/mol
- Monoisotopic mass
- 331.90475
Names & identifiers
- Preferred name
- 3-Bromo-3-(bromo(phenyl)methyl)dihydro-2(3H)-furanone
- IUPAC
- 3-bromo-3-[bromo(phenyl)methyl]oxolan-2-one
Names & synonyms
3-Bromo-3-(bromo(phenyl)methyl)dihydro-2(3H)-furanone5461-04-1NSC23701NSC 237013-bromo-3-[bromo(phenyl)methyl]oxolan-2-oneDTXSID10969871NSC-237013-bromo-3-[bromo(phenyl)methyl]tetrahydrofuran-2-one
Database identifiers
- CAS
5461-04-1- PubChem CID
- 229757
- DTXSID
DTXSID10969871
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 251
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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