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97239-80-0

Basic Information
CAS No.: 97239-80-0
Name: 1,1'-Bis(diisopropylphosphino)ferrocene
Article Data: 4
Molecular Structure:
Molecular Structure of 97239-80-0 (1,1'-Bis(diisopropylphosphino)ferrocene)
Formula: C22H36FeP2
Molecular Weight: 418.322
Synonyms: 1,1'-Bis(diisopropylphosphino)ferrocene;
EINECS: 677-500-6
Melting Point: 50-52 °C(lit.)
Flash Point: >230°F
Solubility: Insoluble in water.
Appearance: orange crystalline powder
Hazard Symbols: IrritantXi
Risk Codes: 36/37/38
Safety: 37/39-26
PSA: 27.18000
LogP: 6.72050
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Specification

The 1,1'-Bis(diisopropylphosphino)ferrocene is an organic compound with the formula C22H36FeP2. The systematic name of this chemical is bis(2-diisopropylphosphanylcyclopenta-2,4-dien-1-yl)iron. With the CAS registry number 97239-80-0, it is also named as 1,1'-Bis(diisopropylphosphino)ferrocene. The product's categories are Ligand; Ferrocenes; Metallocenes; Phosphine Ligands; Synthetic Organic Chemistry; Catalysis and Inorganic Chemistry; Phosphorus Compounds; Polydentate Phosphine Ligands. Besides, it is an orange crystalline powder, which should be stored in a closed cool and dry place.

When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: CC(C)P(C1=CC=CC1[Fe]C2C=CC=C2P(C(C)C)C(C)C)C(C)C
(2)InChI: InChI=1/2C11H18P.Fe/c2*1-9(2)12(10(3)4)11-7-5-6-8-11;/h2*5-10H,1-4H3;/rC22H36FeP2/c1-15(2)24(16(3)4)21-13-9-11-19(21)23-20-12-10-14-22(20)25(17(5)6)18(7)8/h9-20H,1-8H3
(3)InChIKey: LPBBEMRSRONKMN-SHXMOGAVAI
(4)Std. InChI: InChI=1S/2C11H18P.Fe/c2*1-9(2)12(10(3)4)11-7-5-6-8-11;/h2*5-10H,1-4H3;
(5)Std. InChIKey: LPBBEMRSRONKMN-UHFFFAOYSA-N