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Basic information
- CAS
66470-81-3- Standard SMILES
FC(F)(F)C(OP(OC(C(F)(F)F)C(F)(F)F)OC(C(F)(F)F)C(F)(F)F)C(F)(F)F- InChIKey
MJOVEPJSFHDSOJ-UHFFFAOYSA-N- Molecular formula
- C9H3F18O3P
- Average molar mass
- 532.06 g/mol
- Monoisotopic mass
- 531.9532379
Names & identifiers
- Preferred name
- Tris(1,1,1,3,3,3-hexafluoro-2-propyl) phosphite
- IUPAC
- tris(1,1,1,3,3,3-hexafluoropropan-2-yl) phosphite
- English name
- TRIS(1,1,1,3,3,3-HEXAFLUORO-2-PROPYL) PHOSPHITE
- Molecular formula
- C9H3F18O3P
- Molecular weight
- 532.06
Names & synonyms
Tris(1,1,1,3,3,3-hexafluoro-2-propyl) phosphiteRefChem:900100623-540-466470-81-3tris(1,1,1,3,3,3-hexafluoropropan-2-yl) phosphiteTris(1,1,1,3,3,3-hexafluoro-2-propyl)phosphiteMFCD00192561NSC334060A835470C9H3F18O3PSCHEMBL2378613tris(hexafluoroisopropyl)phosphite
Show more names
tris(2h-perfluoro-2-propyl) phosphiteTris(1,1,1,3,3,3-hexafluoro-2-propoxy)phosphiteTris(1,1,1,3,3,3-hexafluoro-2-propyl) phosphite 98%2-Propanol, 1,1,1,3,3,3-hexafluoro-, 2,2',2''-phosphitePhosphorous Acid Tris(1,1,1,3,3,3-hexafluoro-2-propyl) Ester
DTXSID20318694Tris[2,2,2-trifluoro-1-(trifluoromethyl)ethyl] phosphitetris[1,1,1,3,3,3-hexakis(fluoranyl)propan-2-yl] phosphitephosphorous acid tris(1,1,1,3,3,3-hexafluoropropan-2-yl) esterAKOS025310360NSC-334060AS-67362SY235278
Database identifiers
- CAS
66470-81-3
Properties
Computed structural propertiesFilling in
- XLogP
- 7
- Topological polar surface area
- 27.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 21
- Rotatable bonds
- 6
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 444
Physicochemical properties
- Boiling point
- 130 °C · 130 °C (lit.)
- Density
- 1.69 g/mL · 1.69 g/mL at 25 °C (lit.)
- refractive index
- 20 · n20/D 1.300(lit.)
- form
- clear liquid
- color
- Colorless to Almost colorless
- BRN
- 2315565 · 2315565
- InChI
- 1S/C9H3F18O3P/c10-4(11,12)1(5(13,14)15)28-31(29-2(6(16,17)18)7(19,20)21)30-3(8(22,23)24)9(25,26)27/h1-3H
- InChIKey
- MJOVEPJSFHDSOJ-UHFFFAOYSA-N
- SMILES
- FC(F)(F)C(OP(OC(C(F)(F)F)C(F)(F)F)OC(C(F)(F)F)C(F)(F)F)C(F)(F)F
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P271-P280-P302+P352-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (100%)
Safety data
- PPE
- Eyeshields, Gloves, type ABEK (EN14387) respirator filter
- wgk
- 3
- hs_code
- 2920290090
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36
- Storage Class
- 10 - Combustible liquids
Chemistry & industry
Applications
UsesTris(1,1,1,3,3,3-hexafluoro-2-propyl) Phosphite acts as a catalyst in combination with rhodium complex in the hydroformylation of olefins.
General DescriptionTris(1,1,1,3,3,3-hexafluoro-2-propyl) phosphite (tris(1,1,1,3,3,3-hexafluoroisopropyl) phosphite) is a sterically hindered, weakly σ-donating and strongly π-accepting ligand. It can be prepared by the reaction of lithium salt of 1,1,1,3,3,3-hexafluoro-2-propoxide with PCl3. It reacts with nucleosides to form deoxyribonucleoside 3′-bis(1,1,1,3,3,3-hexafluoro-2-propyl) phosphite units.
Upstream & downstream products
Upstream raw materials
Suppliers34 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）
Related reactions
7 records
Compound notes
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