Basic information
- CAS
17978-77-7- Standard SMILES
CC(C)(C)/C([O-])=C/C(=O)C(F)(F)C(F)(F)C(F)(F)F.CC(C)(C)/C([O-])=C/C(=O)C(F)(F)C(F)(F)C(F)(F)F.CC(C)(C)/C([O-])=C/C(=O)C(F)(F)C(F)(F)C(F)(F)F.[Pr+3]- InChIKey
GZFHBLZCACQJBL-VNGPFPIXSA-K- Molecular formula
- C30H30F21O6Pr
- Average molar mass
- 1,026.4 g/mol
- Monoisotopic mass
- 1,026.07836
Names & identifiers
- Preferred name
- Praseodymium, tris(6,6,7,7,8,8,8-heptafluoro-2,2-dimethyl-3,5-octanedionato-kappaO3,kappaO5)-
- IUPAC
- tris((Z)-6,6,7,7,8,8,8-heptafluoro-2,2-dimethyl-5-oxooct-3-en-3-olate);praseodymium(3+)
- English name
- Pr(fod)3
- Molecular formula
- C30H30F21O6Pr
- Molecular weight
- 1026.44
Names & synonyms
Praseodymium, tris(6,6,7,7,8,8,8-heptafluoro-2,2-dimethyl-3,5-octanedionato-kappaO3,kappaO5)-RefChem:868401Praseodymium, tris(6,6,7,7,8,8,8-heptafluoro-2,2-dimethyl-3,5-octanedionato-.kappa.O3,.kappa.O5)-NSC 379436EINECS 241-902-6NSC379436Praseodymium, tris(6,6,7,7,8,8,8-heptafluoro-2,2-dimethyl-3,5-octanedionato-kappaO,kappaO')-Tris(6,6,7,7,8,8,8-heptafluoro-2,2-dimethyloctane-3,5-dionato-O,O')praseodymiumPr(fod)3Tris(6,6,7,7,8,8,8-heptafluoro-2,2-dimethyl-3,5-octanedionato)praseodymium(III) [NMR Shift Reagent]Praseodymium, tris(6,6,7,7,8,8,8-heptafluoro-2,2-dimethyl-3,5-octanedionato-.kappa.O,.kappa.O')-Tris(6,6,7,7,8,8,8-heptafluoro-2,2-dimethyl-3,5-octanedionato)praseodymium(III)
Show more names
Rondeausresolve-al prfodRONDEAU'S REAGENTPRASEODYMIUM(FOD)PRASEODYMIUM (FOD)3RESOLVE-AL(TM) PRFODRESOLVE-AL PRFOD 99+%PR(FOD)3 ISO 9001：2015 REACH
Properties
Computed structural properties
- Topological polar surface area
- 120 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 27
- Rotatable bonds
- 12
- Heavy atoms
- 58
- Formal charge
- 0
- Complexity
- 388
Experimental & physicochemical properties
PFASPFAS -> OECD Category
Physicochemical properties
- Melting point
- 215 · 215-219 °C(lit.)
- Boiling point
- 130 °C · 130°C 0,01mm
- solubility
- Soluble in hexane, methanol, tetrahydrofuran.
- form
- Powder
- color
- light green
- Sensitive
- Hygroscopic
- Hydrolytic Sensitivity
- 4 · 4: no reaction with water under neutral conditions
- EPA Substance Registry System
- Praseodymium, tris(6,6,7,7,8,8,8-heptafluoro-2,2-dimethyl-3,5-octanedionato-.kappa.O,.kappa.O')- (17978-77-7)
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 24 · 24/25
- WGK Germany
- 3 · 3
- TSCA
- TSCA listed
- HS Code
- 2931.9 · 2931.90.9051
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- wgk
- 3
- tsca
- TSCA listed
- hs_code
- 2931.90.9051
- risk_code
- 36/37/38
- safety_code
- 24/25
Chemistry & industry
Uses & manufacturing
Use ClassificationPFAS (per- and polyfluoroalkyl substances) -> OECD Category
General Manufacturing InformationPraseodymium, tris(6,6,7,7,8,8,8-heptafluoro-2,2-dimethyl-3,5-octanedionato-.kappa.O3,.kappa.O5)-: ACTIVE
Applications
UsesTris(6,6,7,7,8,8,8-heptafluoro-2,2-dimethyl-3,5-octanedionato)praseodymium(III) is an NMR shift reagent. Being a lanthanide Tris(β-diketonate), Tris(6,6,7,7,8,8,8-heptafluoro-2,2-dimethyl-3,5-octanedionato)praseodymium(III) is used as a probe for chirality determination of biological amino alcohols via ligand-to-ligand chirality transfer.
Suppliers27 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海源象化学有限公司17312431727 · [email protected]
Aladdin Scientific[email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
Hunan russell chemicals technology co ltd
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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