| CAS Number | 33027-66-6 |
| Catalog Number | AG00CHJR(AGN-PC-0R8GUX) |
| Chemical Name | 1,3,5,2,4,6-triazatriphosphorine, 2-ethoxy-2,4,4,6,6-pentafluoro-2,2,4,4,6,6-hexahydro- |
| IUPAC Name | 2-ethoxy-2,4,4,6,6-pentafluoro-1,3,5-triaza-2λ5,4λ5,6λ5-triphosphacyclohexa-1,3,5-triene |
| InChI | InChI=1S/C2H5F5N3OP3/c1-2-11-14(7)9-12(3,4)8-13(5,6)10-14/h2H2,1H3 |
| InChI Key | CBTAIOOTRCAMBD-UHFFFAOYSA-N |
| MDL Number | MFCD28386107 |
| Molecular Formula | C2H5F5N3OP3 |
| Molecular Weight | 274.9939 |
| SMILES | FP1(F)=NP(F)(OCC)=NP(F)(F)=N1 |
| Synonyms | Ethoxy(pentafluoro)cyclotriphosphazene,
33027-66-6,
2-Ethoxy-2,4,4,6,6-pentafluoro-1,3,5,2,4,6-triazatriphosphorine,
SCHEMBL11936596,
MFCD28386107,
ZINC139380764,
E1140,
|
| Complexity | 361 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 274.957g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 9 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 274.995g/mol |
| Monoisotopic Mass | 274.957g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 46.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.7 |
GHS Hazard and Precautionary Statements
| Symbol: |   |
|
Hazard Class
|
8
|
|
Hazard statements
|
H314-H411
|
|
Packing Group
|
Ⅲ
|
|
Precautionary statements
|
P501-P273-P264-P280-P391-P303+P361+P353-P301+P330+P331-P363-P304+P340+P310-P305+P351+P338+P310-P405
|
|
UN Code
|
UN 1760
|
Certificate of Analysis
Lot Number