3,3-Dichlorodihydrofuran-2(3H)-one
Basic information
- CAS
1588-60-9- Standard SMILES
O=C1OCCC1(Cl)Cl- InChIKey
IWXYAXGKGAHXPV-UHFFFAOYSA-N- Molecular formula
- C4H4Cl2O2
- Average molar mass
- 154.98 g/mol
- Monoisotopic mass
- 153.9588348
Names & identifiers
- Preferred name
- 3,3-Dichlorodihydrofuran-2(3H)-one
- IUPAC
- 3,3-dichlorooxolan-2-one
- English name
- 3,3-dichlorodihydrofuran-2(3H)-one
- Molecular formula
- C4H4Cl2O2
- Molecular weight
- 154.98
Names & synonyms
3,3-Dichlorodihydrofuran-2(3H)-one3,3-dichlorooxolan-2-one1588-60-93,3-Dichlorodihydro-2(3H)-furanone2(3H)-FURANONE, 3,3-DICHLORODIHYDRO-EINECS 216-451-3FZ6AGF98FLSCHEMBL981063alpha,alpha-dichlorobutyrolactoneDTXSID301665273,3-Dichlorodihydro-2(3H)-furanone #NS00025170
Database identifiers
- CAS
1588-60-9- PubChem CID
- 74114
- DTXSID
DTXSID30166527- UNII
- FZ6AGF98FL
- EC Number
- 216-451-3
- Nikkaji
- J100.188D
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 121
Physicochemical properties
- Boiling point
- 110 · 110-115 °C(Press: 14 Torr)
- Density
- 1.479 g/cm3 · 1.4790 g/cm3
- FDA UNII
- 6 AGF98FL · FZ6AGF98FL
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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