(1R)-1-hydroxy-5-oxocyclohex-3-ene-1-carboxylic acid

Base Information

Chemical Name:(1R)-1-hydroxy-5-oxocyclohex-3-ene-1-carboxylic acid
CAS No.:233271-89-1
Molecular Formula:C₇H₈O₄
Molecular Weight:156.138
Hs Code.:
DSSTox Substance ID:DTXSID40445618
Wikidata:Q82264100
Mol file:233271-89-1.mol

Synonyms:233271-89-1;CTK1A0315;DTXSID40445618

Suppliers and Price of (1R)-1-hydroxy-5-oxocyclohex-3-ene-1-carboxylic 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 1 raw suppliers

Chemical Property of (1R)-1-hydroxy-5-oxocyclohex-3-ene-1-carboxylic acid

Chemical Property:

PSA：74.60000
LogP:-0.27880
XLogP3:-0.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:156.04225873
Heavy Atom Count:11
Complexity:231

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1C=CC(=O)CC1(C(=O)O)O
Isomeric SMILES:C1C=CC(=O)C[C@]1(C(=O)O)O

Technology Process of (1R)-1-hydroxy-5-oxocyclohex-3-ene-1-carboxylic acid

There total 4 articles about (1R)-1-hydroxy-5-oxocyclohex-3-ene-1-carboxylic 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: 17.0%

: 232952-12-4
(1R,3R,5R)-1,3-dihydroxycyclohexane-1,5-carbolactone

: 233271-89-1
(1R)-1-hydroxy-3-oxocyclohex-4-enecarboxylic acid

: (1R,5R)-1-hydroxy-3-oxocyclohexane-1,5-carbolactone

Guidance literature:: With 4 A molecular sieve; pyridinium chlorochromate; In dichloromethane; for 2h; Ambient temperature;

Reference yield:

: (1R,3R,5R)-3-(tert-butyldimethylsilyloxy)-1-hydroxycyclohexane-1,5-carbolactone

: 233271-89-1
(1R)-1-hydroxy-3-oxocyclohex-4-enecarboxylic acid

Guidance literature:: Multi-step reaction with 2 steps

1: 99 percent / TBAF, glacial acetic acid / tetrahydrofuran / 36 h / Ambient temperature

2: 17 percent / PCC, molecular sieves 4 Angstroem / CH₂Cl₂ / 2 h / Ambient temperature

With 4 A molecular sieve; tetrabutyl ammonium fluoride; acetic acid; pyridinium chlorochromate; In tetrahydrofuran; dichloromethane;

Reference yield:

: (1R,3R,4S,5R)-1,4-Dihydroxy-3-(1-methyl-1-trimethylsilanyl-ethoxy)-6-oxa-bicyclo[3.2.1]octan-7-one

: 233271-89-1
(1R)-1-hydroxy-3-oxocyclohex-4-enecarboxylic acid

Guidance literature:: Multi-step reaction with 4 steps

1: 62 percent / DMAP / acetonitrile / 24 h / Ambient temperature

2: 88 percent / Bu₃SnH, AIBN / toluene / 1 h / Heating

3: 99 percent / TBAF, glacial acetic acid / tetrahydrofuran / 36 h / Ambient temperature

4: 17 percent / PCC, molecular sieves 4 Angstroem / CH₂Cl₂ / 2 h / Ambient temperature

With dmap; 2,2'-azobis(isobutyronitrile); 4 A molecular sieve; tetrabutyl ammonium fluoride; tri-n-butyl-tin hydride; acetic acid; pyridinium chlorochromate; In tetrahydrofuran; dichloromethane; toluene; acetonitrile;