1,1'-Bis(di-tert-butylphosphino)ferrocene

C₂₆H₄₄FeP₂CAS 84680-95-5474.43 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₂₆H₄₄FeP₂
Molar mass: 474.43 g/mol
Exact mass: 474.2268 Da
logP: 8.22Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 2

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

84680-95-5

SMILES

CC(C)(C)P(C1=CC=C[CH-]1)C(C)(C)C.CC(C)(C)P(C1=CC=C[CH-]1)C(C)(C)C.[Fe+2]

InChIKey

WDUDHEOUGWAKFD-UHFFFAOYSA-N

InChI

InChI=1S/2C13H22P.Fe/c2*1-12(2,3)14(13(4,5)6)11-9-7-8-10-11;/h2*7-10H,1-6H3;/q2*-1;+2

Weigh it out

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Work with 1,1'-Bis(di-tert-butylphosphino)ferrocene

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1,1′-Bis(diphenylphosphino)ferrocene12150-46-848 % similar (SP-4-2)-[1,1′-Bis[bis(1-methylethyl)phosphino-κP]ferrocene]dichloropalladium215788-65-144 % similar 1,1′-Dimethylferrocene1291-47-042 % similar Dichloro[ferrocene-1,1′-diylbis(diphenylphosphine-P)]cobalt(II)67292-36-841 % similar (1,1'-Bis(diphenylphosphino)ferrocene)palladium(II) dichloride72287-26-441 % similar Di-tert-butylphenylphosphine32673-25-939 % similar 1,1′-Diethylferrocene1273-97-838 % similar Palladium, [1,1′-bis(diphenylphosphino-κP)ferrocene]dichloro-, (SP-4-2)-, compd. with 2-propanone (1:1)851232-71-836 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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