730459

(2S,2′S-(−)-[N,N′-Bis(2-pyridylmethyl)]-2,2′-bipyrrolidinebis(acetonitrile)iron(II) hexafluoroantimonate

• Synonym(s): Fe(S,S-PDP), Iron(II) (S,S-(2-({(S)-2-[(S)-1-(pyridin-2-ylmethyl)pyrrolidin-2-yl]pyrrolidin-1-yl}methyl)pyridine)(bis-acetonitrile) hexafluoroantimonate, White Catalyst, [Fe(S,S-PDP)(CH₃CN)₂](SbF₆)₂
• Empirical Formula (Hill Notation): C₂₄H₃₂F₁₂FeN₆Sb₂
• CAS Number: 959395-10-9
• Molecular Weight: 931.90
• MDL number: MFCD16038114
• UNSPSC Code: 12352300
• PubChem Substance ID: 329764568
• NACRES: NA.22

Properties

• form: powder
• Quality Level: 100
• optical activity: [α]20/D −30.0 to −20.0°, c = 0.2 in acetonitrile
• reaction suitability: core: iron; reagent type: catalyst; reaction type: C-H Activation
• mp: >300 °C
• SMILES string: [Fe++].CC#N.CC#N.F[Sb-](F)(F)(F)(F)F.F[Sb-](F)(F)(F)(F)F.C1C[C@H]([C@H]2CCCN2Cc3ccccn3)N(C1)Cc4ccccn4
• InChI: 1S/C20H26N4.2C2H3N.12FH.Fe.2Sb/c1-3-11-21-17(7-1)15-23-13-5-9-19(23)20-10-6-14-24(20)16-18-8-2-4-12-22-18;2*1-2-3;;;;;;;;;;;;;;;/h1-4,7-8,11-12,19-20H,5-6,9-10,13-16H2;2*1H3;12*1H;;;/q;;;;;;;;;;;;;;;+2;2*+5/p-12/t19-,20-;;;;;;;;;;;;;;;;;/m1................./s1
• InChI key: XUNWHBGEOCZDBX-QSKJABRXSA-B

Description

Application

Catalyst for greener ketone synthesis by selective C-H oxidation of methylenes.

Combined Effects on Selectivity in Fe-Catalyzed Methylene Oxidation

Catalyst for:

• Oxidative radical reactions
• Selective oxidation of alkyl carbon-hydrogen bonds
• Methylene group oxidation

Safety Information

• pictograms: GHS07
• signalword: Warning
• hcodes: H315,H319,H335
• pcodes: P261 - P264 - P271 - P280 - P302 + P352 - P305 + P351 + P338
• Hazard Classifications: Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
• target_organs: Respiratory system
• Storage Class: 11 - Combustible Solids
• wgk_germany: WGK 3
• flash_point_f: Not applicable
• flash_point_c: Not applicable