5-(2-Hydroxyphenyl)-1-(3-mercapto-1-oxopropyl)proline

Base Information

Chemical Name:5-(2-Hydroxyphenyl)-1-(3-mercapto-1-oxopropyl)proline
CAS No.:75664-11-8
Molecular Formula:C₁₄H₁₇NO₄S
Molecular Weight:295.359
Hs Code.:
DSSTox Substance ID:DTXSID60997104

Synonyms:alpha-5-(2-Hydroxyphenyl)-1-(3-mercaptopropanoyl)-2-pyrrolidinecarboxylic acid;5-(2-Hydroxyphenyl)-1-(3-mercapto-1-oxopropyl)proline;Proline, 5-(2-hydroxyphenyl)-1-(3-mercapto-1-oxopropyl)-;75664-11-8;DTXSID60997104;LS-118955;5-(2-Hydroxyphenyl)-1-(3-sulfanylpropanoyl)proline

Suppliers and Price of 5-(2-Hydroxyphenyl)-1-(3-mercapto-1-oxopropyl)proline

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
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Total 0 raw suppliers

Chemical Property of 5-(2-Hydroxyphenyl)-1-(3-mercapto-1-oxopropyl)proline

Chemical Property:

Vapor Pressure:4.5E-11mmHg at 25°C
Boiling Point:506.3°C at 760 mmHg
Flash Point:260°C
Density:1.364g/cm³
XLogP3:1.2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:295.08782920
Heavy Atom Count:20
Complexity:376

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CC(N(C1C2=CC=CC=C2O)C(=O)CCS)C(=O)O
Isomeric SMILES:C1CC(N([C@@H]1C(=O)O)C(=O)CCS)C2=CC=CC=C2O

Technology Process of 5-(2-Hydroxyphenyl)-1-(3-mercapto-1-oxopropyl)proline

There total 8 articles about 5-(2-Hydroxyphenyl)-1-(3-mercapto-1-oxopropyl)proline 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: 85.0%

: 75664-12-9,76016-11-0,76016-12-1,105560-85-8,105560-86-9,105560-87-0
(+/-)-1-<3-(benzoylthio)propionyl>-5-(2-hydroxyphenyl)-2-pyrrolidinecarboxylic acid

: 75664-11-8,76016-13-2,76016-14-3,79734-69-3,79734-70-6,105497-84-5,105497-85-6,105497-86-7
(+/-)-5-(2-hydroxyphenyl)-1-(3-mercaptopropionyl)-2-pyrrolidinecarboxylic acid

Guidance literature:: With ammonium hydroxide; In water; for 1h; Ambient temperature;
DOI:10.1248/cpb.33.4836

Reference yield:

: 118-93-4,104809-67-8
o-hydroxyacetophenone

: 75664-11-8,76016-13-2,76016-14-3,79734-69-3,79734-70-6,105497-84-5,105497-85-6,105497-86-7
(+/-)-5-(2-hydroxyphenyl)-1-(3-mercaptopropionyl)-2-pyrrolidinecarboxylic acid

Guidance literature:: Multi-step reaction with 8 steps

1: 46 percent / hydrogen chloride / ethanol / 6 h / Heating

2: NaOEt / ethanol / Ambient temperature

3: 1 h / Heating

4: 52 percent / 6N HCl / 4 h / Heating

5: 90 percent / 3N NaOH / H₂O / pH 4

6: H₂, 1N HCl / PtO₂ / H₂O

7: K₂CO₃ / H₂O / 1 h / under ice cooling

8: 85 percent / conc. ammonia / H₂O / 1 h / Ambient temperature

With hydrogenchloride; ammonium hydroxide; sodium hydroxide; hydrogen; sodium ethanolate; potassium carbonate; platinum(IV) oxide; In ethanol; water;
DOI:10.1248/cpb.33.4836

Reference yield:

: 2752-88-7
1-(2-hydroxyphenyl)-3-morpholinopropanone hydrochloride

: 75664-11-8,76016-13-2,76016-14-3,79734-69-3,79734-70-6,105497-84-5,105497-85-6,105497-86-7
(+/-)-5-(2-hydroxyphenyl)-1-(3-mercaptopropionyl)-2-pyrrolidinecarboxylic acid

Guidance literature:: Multi-step reaction with 7 steps

1: NaOEt / ethanol / Ambient temperature

2: 1 h / Heating

3: 52 percent / 6N HCl / 4 h / Heating

4: 90 percent / 3N NaOH / H₂O / pH 4

5: H₂, 1N HCl / PtO₂ / H₂O

6: K₂CO₃ / H₂O / 1 h / under ice cooling

7: 85 percent / conc. ammonia / H₂O / 1 h / Ambient temperature

With hydrogenchloride; ammonium hydroxide; sodium hydroxide; hydrogen; sodium ethanolate; potassium carbonate; platinum(IV) oxide; In ethanol; water;
DOI:10.1248/cpb.33.4836