6,8-dichloro-4H-1,3-benzodioxine
Basic information
- CAS
7355-99-9- Standard SMILES
Clc1cc(Cl)c2c(c1)COCO2- InChIKey
ZJFGGKYLGUUMPU-UHFFFAOYSA-N- Molecular formula
- C8H6Cl2O2
- Average molar mass
- 205.03 g/mol
- Monoisotopic mass
- 203.9744848
Names & identifiers
- Preferred name
- 6,8-dichloro-4H-1,3-benzodioxine
- IUPAC
- 6,8-dichloro-4H-1,3-benzodioxine
Names & synonyms
6,8-dichloro-4H-1,3-benzodioxine7355-99-94H-1,3-Benzodioxin,6,8-dichloro-NSC41080SCHEMBL11846764DTXSID60285215NSC-41080STK817669AKOS0022255896,8-Dichloro-2H,4H-1,3-benzodioxine6,8-dichloro-2H,4H-benzo[e]1,3-dioxaneST45206246
Database identifiers
- CAS
7355-99-9- PubChem CID
- 237483
- DTXSID
DTXSID60285215
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 165
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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