Bis[2-(diphenylphosphino)phenyl] ether
Basic information
- CAS
166330-10-5- Standard SMILES
c1ccc(P(c2ccccc2)c2ccccc2Oc2ccccc2P(c2ccccc2)c2ccccc2)cc1- InChIKey
RYXZOQOZERSHHQ-UHFFFAOYSA-N- Molecular formula
- C36H28OP2
- Average molar mass
- 538.6 g/mol
- Monoisotopic mass
- 538.16153878
Overview
See also: Bis((diphenylphosphino)phenyl)ether (annotation moved to).
Names & identifiers
- Preferred name
- Bis[2-(diphenylphosphino)phenyl] ether
- IUPAC
- [2-(2-diphenylphosphanylphenoxy)phenyl]-diphenylphosphane
- English name
- (Oxydi-2,1-phenylene)bis(diphenylphosphine)
- Molecular formula
- C36H28OP2
- Molecular weight
- 538.55
Names & synonyms
Bis[2-(diphenylphosphino)phenyl] Etherbis(2-(diphenylphosphino)phenyl) etherRefChem:568683166330-10-5Bis(2-diphenylphosphinophenyl)etherDPEphos(Oxydi-2,1-phenylene)bis(diphenylphosphine)(Oxybis(2,1-phenylene))bis(diphenylphosphine)Bis(2-diphenylphosphinophenyl) etherBis[(2-diphenylphosphino)phenyl] etherMFCD00233863bis[2-(diphenylphosphino)phenyl]ether
Show more names
1-(diphenylphosphino)-2-(2-(diphenylphosphino)phenoxy)benzeneDK994Bis(2-diphenyphosphinophenyl)ether{2-[2-(diene)bis(diphenyL(Oxydi-2,1-phenyL(OXYDI-2,1-PHENYLENE
{2-[2-(diphenylphosphanyl)phenoxy]phenyl}diphenylphosphane2,2'-Bis(diphenylphosphino)diphenyl EtherC36H28OP2[2-(2-diphenylphosphanylphenoxy)phenyl]-diphenylphosphane(oxybis(2,1-phenylene))bis(diphenylphosphane)Phosphine, 1,1'-[(oxydi-2,1-phenylene)]bis[1,1-diphenyl-[2-(2-diphenylphosphanylphenoxy)phenyl]-diphenyl-phosphaneSB34145
Properties
Computed structural properties
- XLogP
- 8.8
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 8
- Heavy atoms
- 39
- Formal charge
- 0
- Complexity
- 594
Physicochemical properties
- Melting point
- 184 · 184-187 °C (lit.)
- Boiling point
- 608.2 · 608.2±40.0 °C(Predicted)
- storage temp.
- Keep in dark place,Sealed in dry,Room Temperature
- solubility
- Chloroform (Slightly), Methanol (Slightly)
- form
- Crystalline Powder or Crystals
- color
- White to off-white
- BRN
- 7729718 · 7729718
- InChI
- InChI=1S/C36H28OP2/c1-5-17-29(18-6-1)38(30-19-7-2-8-20-30)35-27-15-13-25-33(35)37-34-26-14-16-28-36(34)39(31-21-9-3-10-22-31)32-23-11-4-12-24-32/h1-28H
- InChIKey
- RYXZOQOZERSHHQ-UHFFFAOYSA-N
- SMILES
- C1C=CC(OC2C=CC=CC=2P(C2=CC=CC=C2)C2C=CC=CC=2)=C(P(C2C=CC=CC=2)C2=CC=CC=C2)C=1
- CAS DataBase Reference
- 166330 · 166330-10-5(CAS DataBase Reference)
- UNSPSC Code
- 12352112 · 12352112
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 7 · GHS07
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- PPE
- Eyeshields, Gloves, type N95 (US)
- wgk
- 3
- tsca
- No
- hs_code
- 29319090
- risk_code
- 36/37/38-22
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- safety_code
- 37/39-26
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313-P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Chemistry & industry
Applications
Usessuzuki reaction
UsesLigand for ruthenium-catalyzed greener amine synthesis from amines and alcohols by hydrogen-borrowing.Ruthenium-Catalyzed N-Alkylation of Amines and Sulfonamides Using Borrowing Hydrogen Methodology
General DescriptionThis product has been enhanced for catalytic efficiency.
Upstream & downstream products
Upstream raw materials
Downstream products
Related reactions
725 records
Compound notes
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