7-[(1S,2R)-2-hexyl-5-hydroxycyclopentyl]heptanoic acid

Base Information

• Chemical Name: 7-[(1S,2R)-2-hexyl-5-hydroxycyclopentyl]heptanoic acid
• CAS No.: 56695-65-9
• Molecular Formula: C₁₈H₃₄O₃
• Molecular Weight: 298.466
• European Community (EC) Number: 260-341-8
• Nikkaji Number: J1.101.133K
• Mol file: 56695-65-9.mol

Synonyms:56695-65-9;AKOS040746298

Chemical Property of 7-[(1S,2R)-2-hexyl-5-hydroxycyclopentyl]heptanoic acid

Chemical Property:

• Vapor Pressure: 1.13E-09mmHg at 25°C
• Boiling Point: 442.1°C at 760 mmHg
• PKA: 4.78±0.10(Predicted)
• Flash Point: 235.3°C
• Density: 0.981g/cm³
• XLogP3: 5.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 12
• Exact Mass: 298.25079494
• Heavy Atom Count: 21
• Complexity: 278

Purity/Quality:

98%min ^*data from raw suppliers

ROSAPROSTOL 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCC1CCC(C1CCCCCCC(=O)O)O
• Isomeric SMILES: CCCCCC[C@@H]1CCC([C@H]1CCCCCCC(=O)O)O
• Description: Rosaprostol is an antisecretory and cytoprotective prostaglandin analog useful in the treatment of gastric and duodenal ulcers. Considerably less potent than enprostil or misoprostol, it is reported to lack the typical gastrointestinal and cardiovascular side effects of PGE derivatives.

Technology Process of 7-[(1S,2R)-2-hexyl-5-hydroxycyclopentyl]heptanoic acid

There total 3 articles about 7-[(1S,2R)-2-hexyl-5-hydroxycyclopentyl]heptanoic 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: 88.5%

7-(2-hexyl-5-keto-cyclopentyl)-heptanoic acid (59659-94-8) → 7-(2-hexyl-5-hydroxy-cyclopentyl)-heptanoic acid (56695-65-9,82598-17-2)

Guidance literature:

With hydrogenchloride; sodium hydroxide; sodium borohydrid; In methanol;

Reference yield:

7-[(1R,2S)-2-hexyl-5-oxocyclopentyl]heptanoic acid → 9-hydroxy-19,20-bis-nor-prostanoic acid (56695-65-9,82598-17-2,128948-48-1,128948-49-2)

Guidance literature:

With acetic acid; In methanol; water;

Reference yield:

→ 7-(2-hexyl-5-hydroxy-cyclopentyl)-heptanoic acid (56695-65-9,82598-17-2)

Guidance literature:

Keto-carbonsaeure (XVII), NaBH4;

upstream raw materials:

7-(2-hexyl-5-keto-cyclopentyl)-heptanoic acid

Refernces

• 1、 -. "19,20-Bis-nor-prostenoic acids as hypolipemic compounds". . . Retrieved 2008/06/13.