Benzene, 1,5-dinitro-2,4-bis(2,2,2-trifluoroethoxy)-
Basic information
- CAS
144252-49-3- Standard SMILES
O=[N+]([O-])c1cc([N+](=O)[O-])c(OCC(F)(F)F)cc1OCC(F)(F)F- InChIKey
ADCZJXHXRWEVRK-UHFFFAOYSA-N- Molecular formula
- C10H6F6N2O6
- Average molar mass
- 364.15 g/mol
- Monoisotopic mass
- 364.01300489
Names & identifiers
- Preferred name
- Benzene, 1,5-dinitro-2,4-bis(2,2,2-trifluoroethoxy)-
- IUPAC
- 1,5-dinitro-2,4-bis(2,2,2-trifluoroethoxy)benzene
Names & synonyms
Benzene, 1,5-dinitro-2,4-bis(2,2,2-trifluoroethoxy)-144252-49-31,5-dinitro-2,4-bis(2,2,2-trifluoroethoxy)benzeneSCHEMBL9615856DTXSID50389014ADCZJXHXRWEVRK-UHFFFAOYSA-NAKOS000506005ST51186832
Database identifiers
- CAS
144252-49-3- PubChem CID
- 3089239
- DTXSID
DTXSID50389014
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 419
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Related reactions
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Compound notes
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