Bis[1,2-bis(diphenylphosphino)ethane]palladium(0)

C52H48P4PdCAS 31277-98-2903.27 g/mol

Open in Covalent MOL file
PPPPPd
Phosphine

Properties

Molecular formula
C52H48P4Pd
Molar mass
903.27 g/mol
Exact mass
902.1741 Da
logP
10.50Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
14

Hazards

Warning
Irritant (GHS07)

Aggregated from 43 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, P501

Identifiers

CAS number
31277-98-2
SMILES
C1=CC=C(C=C1)P(CCP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.C1=CC=C(C=C1)P(CCP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.[Pd]
InChIKey
FAFGMAGIYHHRKN-UHFFFAOYSA-N
InChI
InChI=1S/2C26H24P2.Pd/c2*1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;/h2*1-20H,21-22H2;

Weigh it out

Type any one amount. The others follow from the molar mass.

Work with Bis[1,2-bis(diphenylphosphino)ethane]palladium(0)

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

1,2-Bis(diphenylphosphino)ethane1663-45-283 % similar Bis(diphenylphosphinoethyl)phenylphosphine23582-02-768 % similar 1,3-Bis(diphenylphosphino)propane6737-42-467 % similar 1,4-Bis(diphenylphosphino)butane7688-25-767 % similar 1,6-Bis(diphenylphosphino)hexane19845-69-364 % similar 1,5-Bis(diphenylphosphino)pentane27721-02-464 % similar 1,2-Bis(diphenylphosphino)ethane nickel(II) chloride14647-23-563 % similar [1,2-Bis(diphenylphosphino)ethane]dichloropalladium(II)19978-61-163 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook