(4-Phenylbutyl)phosphinic acid

Base Information

• Chemical Name: (4-Phenylbutyl)phosphinic acid
• CAS No.: 86552-32-1
• Molecular Formula: C10H15 O2 P
• Molecular Weight: 198.202
• European Community (EC) Number: 420-450-5
• DSSTox Substance ID: DTXSID90473507
• Wikidata: Q82302942
• Mol file: 86552-32-1.mol

Synonyms:(4-PHENYLBUTYL)PHOSPHINIC ACID;86552-32-1;4-phenylbutylphosphinic acid;Hydroxy-oxo-(4-phenylbutyl)phosphanium;Phosphinic acid,(4-phenylbutyl)- (9CI);phenylbutyl phosphinic acid;SCHEMBL2357339;DTXSID90473507;(4-phenyl-butyl)-phosphinic acid;XOVHGRGKNYFTDH-UHFFFAOYSA-N

Chemical Property of (4-Phenylbutyl)phosphinic acid

Chemical Property:

• Boiling Point: 361.2±35.0 °C(Predicted)
• PKA: 3.41±0.10(Predicted)
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 197.07314168
• Heavy Atom Count: 13
• Complexity: 153

Purity/Quality:

99.9% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)CCCC[P+](=O)O

Technology Process of (4-Phenylbutyl)phosphinic acid

There total 7 articles about (4-Phenylbutyl)phosphinic acid 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: 96.0%

4-Phenylbut-1-ene (768-56-9) → (4-phenylbutyl)phosphinic acid (86552-32-1)

Guidance literature:

With polystyrene-NH-CO-nixantphos; hypophosphorous acid; tris-(dibenzylideneacetone)dipalladium⁽⁰⁾; In acetonitrile; Heating;

DOI:10.1021/ol0484198

Reference yield: 96.0%

4-phenylbutyl phosphine → (4-phenylbutyl)phosphinic acid (86552-32-1)

Guidance literature:

With dihydrogen peroxide; In tetrahydrofuran; water;

Reference yield:

sodium hypophosphite (10039-56-2) + 4-Phenylbut-1-ene (768-56-9) → (4-phenylbutyl)phosphinic acid (86552-32-1)

Guidance literature:

With triethyl borane; In methanol; at 20 ℃; for 4h;

upstream raw materials:

4-Phenylbut-1-ene

sodium hypophosphite

diethyl ether

azobisisobutyronitrile

Downstream raw materials:

((E)-1-Hydroxy-but-2-enyl)-(4-phenyl-butyl)-phosphinic acid

(1-Hydroxy-1,3-dimethyl-but-2-enyl)-(4-phenyl-butyl)-phosphinic acid

4-[Hydroxy-(4-phenylbutyl)phosphinyl]-4,4-dimethyl-2-butanone

(3-Oxo-cyclopentyl)-(4-phenyl-butyl)-phosphinic acid