Sodium 3,3',3''-phosphinetriyltribenzenesulfonate

Base Information

• Chemical Name: Sodium 3,3',3''-phosphinetriyltribenzenesulfonate
• CAS No.: 63995-70-0
• Molecular Formula: C18H12Na3O9PS3
• Molecular Weight: 568.429
• Hs Code.: 29319090
• European Community (EC) Number: 264-596-6
• UNII: WUE9W42Q27
• DSSTox Substance ID: DTXSID60213972
• Nikkaji Number: J310.024C
• Wikipedia: TPPTS
• Wikidata: Q424908
• Mol file: 63995-70-0.mol

Synonyms:63995-70-0;Sodium 3,3',3''-phosphinetriyltribenzenesulfonate;Triphenylphosphine-3,3',3''-trisulfonic acid trisodium salt;TPPTS;Tris(3-sulfophenyl)phosphine trisodium salt;WUE9W42Q27;EINECS 264-596-6;trisodium;3-bis(3-sulfonatophenyl)phosphanylbenzenesulfonate;Benzenesulfonic acid, 3,3',3''-phosphinidynetris-, trisodium salt;Trisodium 3,3',3''-phosphinetriyltris(benzene-1-sulphonate);UNII-WUE9W42Q27;C18H15O9PS3.3Na;DTXSID60213972;tris-(3-Sulfornatophenyl)-phosphine 4-hydrate sodium salt;MYAJTCUQMQREFZ-UHFFFAOYSA-K;BCP20106;AKOS015896467;C18-H15-O9-P-S3.3Na;GS-4191;SC11073;Trisodium tris(m-sulfonatophenyl)phosphin;Tri(methyl-sulfophenyl)phosphine,sodium salt;FT-0613971;T2187;tris(3-sulfonatophenyl)phosphine sodium salt;Sodium3,3',3''-phosphinetriyltribenzenesulfonate;TRI(M-SULFOPHENYL)PHOSPHINE, SODIUM SALT;Q424908;J-511045;sodium 3,3',3''-phosphinetriyl-tribenzenesulfonate;sodium 3,3',3''-phosphinetriyltribenzene-sulfonate;Triphenylphosphine-m-trisulfonic acid trisodium salt;Tris-(3-Sulfornatophenyl)-Phosphine4-Hydratesodiumsalt;Trisodium 3,3',3''-Phosphinetriyltribenzenesulfonate;Triphenylphosphine-3,3',3''-trisulfonic acid trisodium;triphenylphosphine-3,3',3"-trisulfonic acid trisodium salt;3,3',3''-phoshinidynetris(benzenesulfonic acid)trisodium salt;3,3',3''-Phosphinidynetris(benzenesulfonic acid) trisodium sal;3,3',3''-phosphinidynetris(benzenesulfonic acid)trisodium salt;3,3',3''-Phosphinidynetris-benzenesulfonic acid trisodium salt;3,3'3''-phosphinidynetris(benzenesulfonic acid) trisodium salt;3,3'3''-phosphinidynetris(benzenesulfonic acid)trisodium salt;trisodium 3-[bis(3-sulfonatophenyl)phosphino]benzenesulfonate;trisodium 3-[bis(3-sulfophenyl)phosphanyl]benzene-1-sulfonate;3,3',3''-phosphinidyne tris(benzenesulphonic acid) trisodium salt;3,3',3''-phosphinidynetris (benzensulfonic acid) trisodium salt;3,3',3''-Phosphinidynetris(benzenesulfonic acid) trisodium salt;TRISODIUM 3,3',3''-PHOSPHINETRIYLTRIS(BENZENE-1-SULFONATE);Benzenesulfonic acid, 3,3',3''-phosphinidynetris-, sodium salt (1:3);Triphenylphosphine-3,3',3''-trisulfonic acid trisodium salt, >=95.0%;Tris(3-sulfonatophenyl)phosphine hydrate, sodium salt (10-15% oxide);Tris(3-sulfonatophenyl)phosphine tetrahydrate, sodium salt (10-15% oxide)

Chemical Property of Sodium 3,3',3''-phosphinetriyltribenzenesulfonate

Chemical Property:

• PSA: 210.33000
• LogP: 3.39950
• Storage Temp.: Inert atmosphere,Room Temperature
• Solubility.: DMSO (Slightly), Water (Slightly)
• Water Solubility.: Soluble in water.
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 3
• Exact Mass: 567.90741532
• Heavy Atom Count: 34
• Complexity: 768

Purity/Quality:

99% ^*data from raw suppliers

Tris(3-sulfophenyl)phosphineTrisodium(~85%) ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26

MSDS Files:

SDS file from LookChem

Useful:

• Chemical Classes: Other Classes -> Phosphorus Compounds
• Canonical SMILES: C1=CC(=CC(=C1)S(=O)(=O)[O-])P(C2=CC(=CC=C2)S(=O)(=O)[O-])C3=CC(=CC=C3)S(=O)(=O)[O-].[Na+].[Na+].[Na+]
• Uses: Tris(3-sulfophenyl)phosphine Trisodium Salt is a reagent used in organic synthesis such as benzothiazole-based cycloplatinated chromophores.

Technology Process of Sodium 3,3',3''-phosphinetriyltribenzenesulfonate

There total 16 articles about Sodium 3,3',3''-phosphinetriyltribenzenesulfonate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 98.6%

triphenylphosphine (603-35-0) → trisodium tris(3-sulfophenyl)phosphine (63995-70-0)

Guidance literature:

triphenylphosphine; With chlorosulfonic acid; sulfuric acid; at 0 - 25 ℃;

With sodium hydroxide; In water; at 60 ℃; Temperature; Reagent/catalyst;

Reference yield: 66.0%

tris (3-ethyl phenyl sulfonate) phosphine (135265-27-9) → trisodium tris(3-sulfophenyl)phosphine (63995-70-0)

Guidance literature:

With sodium bromide; In water; acetone; for 48h; Ambient temperature;

DOI:10.1080/00397919108016775

Reference yield: 63.0%

carbonyl(hydrido)tris{tris(sodium-m-sulphonatophenyl)phosphine}rhodium(I)-nonahydrate → trans-carbonyl(hydroxy)bis{tris(sodium-m-sulphonatophenyl)phosphine}rhodium(I)-hexahydrate + trisodium tris(3-sulfophenyl)phosphine (63995-70-0)

Guidance literature:

In water; byproducts: H2; (N2 or Ar); refluxing (12 h, vac.); chromy. (Sephadex); elem. anal.;

DOI:10.1016/0022-328X(90)85395-F

upstream raw materials:

tris(natrium-m-sulfonatophenyl)phosphanoxid

tris (3-ethyl phenyl sulfonate) phosphine

triphenylphosphine

C₁₈H₁₂Cl₃O₆PS₃

Downstream raw materials:

C₂₅H₁₉O₉PS₃^(2-)*Br^(1-)*3Na⁽¹⁺⁾

(2-carboxy-1-phenylethenyl)tris(3-sulfophenyl)phosphonium inner salt, trisodium salt

(2-carboxy-1-phenylethenyl)tris(3-sulfophenyl)phosphonium inner salt, trisodium salt

(E)-3-phenylacrylic acid

Refernces

• 1、 Herrmann, Wolfgang A.,Kulpe, Juergen A.,Konkol, Werner,Bahrmann, Helmut. "Wasserloesliche Metallkomplexe und Katalysatoren II. Verfahren zur Reindarstellung von Tris(natrium-m-sulfonatophenyl)phosphan (TPPTS) und katalyserelevanter Rhodium-Komplexe". . p. 85 - 101. Retrieved 1990.
• 2、 -. "Preparation method of trisulfonated triphenylphosphine TPPTS". Paragraph 0009; 0024-0044; 0050. . Retrieved 2021/05/01.