Clinprost

Base Information Edit

Chemical Name:Clinprost
CAS No.:88931-51-5
Molecular Formula:C₂₂H₃₆O₄
Molecular Weight:364.525
Hs Code.:
UNII:6GRI2J11N5
DSSTox Substance ID:DTXSID201107239
Nikkaji Number:J385.618F
Wikidata:Q27264886
NCI Thesaurus Code:C76332
ChEMBL ID:CHEMBL2104163
Mol file:88931-51-5.mol

Synonyms:clinprost;isocarbacyclin methyl ester;TEI 9090;TEI-9090

Suppliers and Price of Clinprost

Supply Marketing:Edit

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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price

Total 0 raw suppliers

Chemical Property of Clinprost Edit

Chemical Property:

Vapor Pressure:8.97E-11mmHg at 25°C
Boiling Point:469.2°Cat760mmHg
Flash Point:151.9°C
PSA：66.76000
Density:1.089g/cm³
LogP:4.16050
XLogP3:3.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:12
Exact Mass:364.26135963
Heavy Atom Count:26
Complexity:496

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCCC(C=CC1C(CC2C1CC(=C2)CCCCC(=O)OC)O)O
Isomeric SMILES:CCCCC[C@@H](/C=C/[C@H]1[C@@H](C[C@H]2[C@@H]1CC(=C2)CCCCC(=O)OC)O)O

Technology Process of Clinprost

There total 93 articles about Clinprost 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%

: 110972-06-0
<3aS-<3aα,4α(1E,3R^*),5β,6aα>>-methyl 5-pentanoate

: 88931-51-5
isocarbacyclin

Guidance literature:: With trifluoroacetic acid; In dichloromethane; at -78 - -20 ℃; for 14.5h;
DOI:10.1021/jo00234a014

Reference yield: 95.0%

: 98676-84-7
11,15-O-bis(t-butyldimethylsilyl)-9(O)-methano-Δ^6(9α)-prostaglandin I₁ methyl ester

: 88931-51-5
isocarbacyclin

Guidance literature:: With tetrabutyl ammonium fluoride; In tetrahydrofuran; at 35 ℃; for 8h;
DOI:10.1039/c39880001137

Reference yield:

: 65025-95-8
(3aR,4S,5R,6aS)-4-({[dimethyl(2-methyl-2-propanyl)silyl]oxy}methyl)-5-(tetrahydro-2H-pyran-2-yloxy)hexahydro-2H-cyclopenta[b]furan-2-one

: 88931-51-5
isocarbacyclin

Guidance literature:: Multi-step reaction with 16 steps

1: diisobutylaluminum hydride / hexane; toluene / 0.67 h / -75 °C

2: 96 percent / potassium tert-butoxide / tetrahydrofuran / 0.67 h / 23 °C

3: 100 percent / pyridinium chlorochromate, sodium acetate, celite / CH₂Cl₂ / 13 h / 0 °C

4: 90 percent / CH₂Cl₂ / 0.5 h / Ambient temperature

5: 1.) thexylborane, 2.) aq. NaOH, H₂O₂

6: 8 percent / SO₃-pyridine, triethylamine / dimethylsulfoxide / 1.) 23 deg C, 1 h, 2.) 65 deg C, 3.5 h

7: CH₃SOCH₂Na

9: H₂ / Pd/C

10: triethylamine

11: DBU

12: 94 percent / tetra-n-butylammonium fluoride / tetrahydrofuran / 5 h / 23 °C

13: SO₃-pyridine, triethylamine / dimethylsulfoxide / 0.33 h / 23 °C

14: NaH / tetrahydrofuran / 0.67 h / 23 °C

15: NaBH₄ / methanol / 0.33 h / -20 °C

16: acetic acid; H₂O; tetrahydrofuran / 5 h / 45 - 50 °C

With sodium hydroxide; sodium tetrahydroborate; pyridine-SO₃ complex; Celite; thexylborane; potassium tert-butylate; tetrabutyl ammonium fluoride; hydrogen; dihydrogen peroxide; sodium acetate; sodium hydride; diisobutylaluminium hydride; sodium methylsulfinylmethanide; 1,8-diazabicyclo[5.4.0]undec-7-ene; triethylamine; pyridinium chlorochromate; palladium on activated charcoal; In tetrahydrofuran; methanol; hexane; dichloromethane; water; acetic acid; dimethyl sulfoxide; toluene;
DOI:10.1248/cpb.37.586