(5s)-5-(4-Fluorophenyl)-5-hydroxypentanoic acid

Base Information

Chemical Name:(5s)-5-(4-Fluorophenyl)-5-hydroxypentanoic acid
CAS No.:189028-94-2
Molecular Formula:C11H13FO3
Molecular Weight:212.2175232
Hs Code.:
DSSTox Substance ID:DTXSID30431181
Wikidata:Q82245000
Mol file:189028-94-2.mol

Synonyms:189028-94-2;(5s)-5-(4-fluorophenyl)-5-hydroxypentanoic acid;CID 9815728;(S)-5-(4-fluorophenyl)-5-hydroxypentanoic acid;BEN480;SCHEMBL6512170;DTXSID30431181;EN300-198776;(5s)-5-(4-fluorophenyl)-5-hydroxypentanoicacid

Suppliers and Price of (5s)-5-(4-Fluorophenyl)-5-hydroxypentanoic acid

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 3 raw suppliers

Chemical Property of (5s)-5-(4-Fluorophenyl)-5-hydroxypentanoic acid

Chemical Property:

PSA：57.53000
LogP:2.11400
XLogP3:1.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:212.08487243
Heavy Atom Count:15
Complexity:200

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=CC=C1C(CCCC(=O)O)O)F
Isomeric SMILES:C1=CC(=CC=C1[C@H](CCCC(=O)O)O)F

Technology Process of (5s)-5-(4-Fluorophenyl)-5-hydroxypentanoic acid

There total 11 articles about (5s)-5-(4-Fluorophenyl)-5-hydroxypentanoic 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: 91.0%

: 149437-76-3
5-(4-fluorophenyl)-5-oxopentanoic acid

: 189028-94-2
(S)-5-(4-fluorophenyl)-5-hydroxypentanoic acid

Guidance literature:: With [iridium(dihydride)(chloride)((3,5-(tBu)2-C₆H₃)2P)(C₁₇H₁₀)NHCHC₅H₃N(CH₃)]; potassium tert-butylate; hydrogen; In ethanol; at 20 - 50 ℃; under 18751.9 Torr; enantioselective reaction; Autoclave; Schlenk technique; Large scale;
DOI:10.1021/acs.orglett.9b04253

Reference yield:

: 149437-67-2
5-(4-fluorophenyl)-5-oxopentanoic acid methyl ester

: 189028-94-2
(S)-5-(4-fluorophenyl)-5-hydroxypentanoic acid

Guidance literature:: 5-(4-fluorophenyl)-5-oxopentanoic acid methyl ester; With (-)-diisopinocamphenylborane chloride; In tetrahydrofuran; at -35 - -25 ℃; for 20.5h;

With sodium hydroxide; water; In tetrahydrofuran; at 0 ℃; for 1.58333h;

With hydrogenchloride; In water; pH=2.78;