Basic information
- CAS
290-67-5- Standard SMILES
C1=COC=CO1- InChIKey
KVGZZAHHUNAVKZ-UHFFFAOYSA-N- Molecular formula
- C4H4O2
- Average molar mass
- 84.07 g/mol
- Monoisotopic mass
- 84.02112937
Overview
1,4-dioxine is an oxacycle that is 4H-pyran in which the methylene group at position 4 is replaced by an oxygen. Non-aromatic.
Names & identifiers
- Preferred name
- 1,4-Dioxin
- IUPAC
- 1,4-dioxine
- English name
- 1,4-dioxin
- Molecular formula
- C4H4O2
- Molecular weight
- 84.07
Names & synonyms
1,4-Dioxinp-Dioxin290-67-5ZD32358XMGDTXSID10183191RefChem:73339DTXCID201056821,4-dioxine1,4-dioxameSCHEMBL8938UNII-ZD32358XMGSCHEMBL23645
Show more names
1,4-dioxacyclohexa-2,5-dieneCHEBI:134044KVGZZAHHUNAVKZ-UHFFFAOYSA-NNS00123000Q161534
Database identifiers
- CAS
290-67-5- PubChem CID
- 78968
- DTXSID
DTXSID10183191- ChEBI
CHEBI:134044- UNII
- ZD32358XMG
- Nikkaji
- J653.309D
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 6
- Formal charge
- 0
- Complexity
- 63.5
Experimental & physicochemical properties
SpringerMaterials PropertiesSchoenflies notation
Physicochemical properties
- Boiling point
- 75.25 °C · 75.25°C
- Density
- 1.115 · 1.1150
- refractive index
- 1.435 · 1.4350
- FDA UNII
- 32358 XMG · ZD32358XMG
- EPA Substance Registry System
- 1 · 1,4-Dioxin (290-67-5)
Safety & regulation
Hazard information
Peroxide Forming Chemical
1,4-Dioxin
D*: Other compounds that may form peroxides
None - PFC class based on structural similarities
Chemistry & industry
Additional notes
DefinitionChEBI: 1,4-dioxine is an oxacycle that is 4H-pyran in which the methylene group at position 4 is replaced by an oxygen. Non-aromatic.
Related reactions
18 records
Compound notes
Loading…