Basic information
- CAS
81098-47-7- Standard SMILES
C=CCP1(C)=NP(OCC(F)(F)F)(OCC(F)(F)F)=NP(OCC(F)(F)F)(OCC(F)(F)F)=N1- InChIKey
UFCDMQWYUTYHGG-UHFFFAOYSA-N- Molecular formula
- C12H16F12N3O4P3
- Average molar mass
- 587.18 g/mol
- Monoisotopic mass
- 587.0162049
Names & identifiers
- Preferred name
- 2-Methyl-2-prop-2-enyl-4,4,6,6-tetrakis(2,2,2-trifluoroethoxy)-1,3,5-triaza-2lambda5,4lambda5,6lambda5-triphosphacyclohexa-1,3,5-triene
- IUPAC
- 2-methyl-2-prop-2-enyl-4,4,6,6-tetrakis(2,2,2-trifluoroethoxy)-1,3,5-triaza-2λ5,4λ5,6λ5-triphosphacyclohexa-1,3,5-triene
Names & synonyms
81098-47-7UFCDMQWYUTYHGG-UHFFFAOYSA-NNSC367452SCHEMBL21875604DTXSID30320980NSC-3674522,2,4,4-Tetra(trifluoromethylmethoxy)-6-methyl-6-(2-propen-1-yl)cyclotriphosphazene2-Methyl-2-(prop-2-en-1-yl)-4,4,6,6-tetrakis(2,2,2-trifluoroethoxy)-1,3,5,2lambda~5~,4lambda~5~,6lambda~5~-triazatriphosphinine2-Methyl-2-prop-2-enyl-4,4,6,6-tetrakis(2,2,2-trifluoroethoxy)-1,3,5-triaza-2lambda5,4lambda5,6lambda5-triphosphacyclohexa-1,3,5-triene
Database identifiers
- CAS
81098-47-7- PubChem CID
- 339708
- DTXSID
DTXSID30320980
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 74 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 19
- Rotatable bonds
- 10
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 786
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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