chempirical

Bis(diphenylphosphinoethyl)phenylphosphine

C34H33P3CAS 23582-02-7534.56 g/mol

Open in Covalent MOL file
PPP
Phosphine

Properties

Molecular formula
C34H33P3
Molar mass
534.56 g/mol
Exact mass
534.1795 Da
Melting point
131–132 °C
logP
7.06Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
11

Hazards

Warning
Irritant (GHS07)

Aggregated from 41 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
23582-02-7
SMILES
c1ccc(P(CCP(c2ccccc2)c2ccccc2)CCP(c2ccccc2)c2ccccc2)cc1
InChIKey
AXVOAMVQOCBPQT-UHFFFAOYSA-N
InChI
InChI=1S/C34H33P3/c1-6-16-30(17-7-1)35(26-28-36(31-18-8-2-9-19-31)32-20-10-3-11-21-32)27-29-37(33-22-12-4-13-23-33)34-24-14-5-15-25-34/h1-25H,26-29H2

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Names and synonyms

9 names
  • Phosphine, bis[2-(diphenylphosphino)ethyl]phenyl-
  • Phosphine, [(phenylphosphinidene)diethylene]bis[diphenyl-
  • Bis[2-(diphenylphosphino)ethyl]phenylphosphine
  • Triphos
  • Phenylbis(diphenylphosphinoethyl)phosphine
  • NSC 164873
  • NSC 635021
  • ((Phenylphosphinediyl)bis(ethane-2,1-diyl))bis(diphenylphosphine)
  • Bis(2-(diphenylphosphino)ethyl)phenylphosphine

Work with Bis(diphenylphosphinoethyl)phenylphosphine

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)ethane1663-45-279 % similar Bis[1,2-bis(diphenylphosphino)ethane]palladium(0)31277-98-268 % similar 1,3-Bis(diphenylphosphino)propane6737-42-464 % similar 1,4-Bis(diphenylphosphino)butane7688-25-764 % similar 1,6-Bis(diphenylphosphino)hexane19845-69-361 % similar 1,5-Bis(diphenylphosphino)pentane27721-02-461 % similar 1,2-Bis(diphenylphosphino)ethane nickel(II) chloride14647-23-560 % similar [1,2-Bis(diphenylphosphino)ethane]dichloropalladium(II)19978-61-160 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia