2,2,3,3-Tetramethoxy-5,6-bis(4-nitrophenyl)-1,4-dioxine
Basic information
- CAS
85291-05-0- Standard SMILES
COC1(OC)OC(c2ccc([N+](=O)[O-])cc2)=C(c2ccc([N+](=O)[O-])cc2)OC1(OC)OC- InChIKey
UEHYSKJLBPDCBS-UHFFFAOYSA-N- Molecular formula
- C20H20N2O10
- Average molar mass
- 448.4 g/mol
- Monoisotopic mass
- 448.11179484
Names & identifiers
- Preferred name
- 2,2,3,3-Tetramethoxy-5,6-bis(4-nitrophenyl)-1,4-dioxine
- IUPAC
- 2,2,3,3-tetramethoxy-5,6-bis(4-nitrophenyl)-1,4-dioxine
Names & synonyms
85291-05-02,2,3,3-tetramethoxy-5,6-bis(4-nitrophenyl)-1,4-dioxineNSC362897DTXSID90320668NSC-3628972,2,3,3-Tetramethoxy-5,6-bis(4-nitrophenyl)-2,3-dihydro-1,4-dioxine
Database identifiers
- CAS
85291-05-0- PubChem CID
- 338807
- DTXSID
DTXSID90320668
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 147 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 6
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 647
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Compound notes
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