6,9-Thiaprostacyclin

Base Information

Chemical Name:6,9-Thiaprostacyclin
CAS No.:64868-63-9
Molecular Formula:C₂₀H₃₂O₄S
Molecular Weight:368.538
Hs Code.:
Nikkaji Number:J18.520E

Synonyms:6,9-thia-PGX;6,9-thiaprostacyclin

Suppliers and Price of 6,9-Thiaprostacyclin

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 5 raw suppliers

Chemical Property of 6,9-Thiaprostacyclin

Chemical Property:

Vapor Pressure:1.05E-14mmHg at 25°C
Boiling Point:556.5°Cat760mmHg
PKA:4.71±0.10(Predicted)
Flash Point:290.4°C
PSA：103.06000
Density:1.24g/cm³
LogP:4.12510
XLogP3:3.5
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:10
Exact Mass:368.20213067
Heavy Atom Count:25
Complexity:488

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCCC(C=CC1C(CC2C1CC(=CCCCC(=O)O)S2)O)O
Isomeric SMILES:CCCCC[C@@H](/C=C/[C@H]1[C@@H](C[C@H]2[C@@H]1C/C(=C/CCCC(=O)O)/S2)O)O

Technology Process of 6,9-Thiaprostacyclin

There total 17 articles about 6,9-Thiaprostacyclin 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: 55.0%

: 64868-61-7
(5Z)-6,9-thiaprostacyclin methyl ester

: 64868-63-9
(5Z)-6,9-thiaprostacyclin

Guidance literature:: With lithium hydroxide; In tetrahydrofuran; water; for 12h; Ambient temperature;
DOI:10.1021/ja00402a036

Reference yield:

: 64868-58-2
methyl (5Z,9α,11α,13E,15S)-9-(acetylthio)-11,15-bis-<(tetrahydro-2H-pyran-2-yl)oxy>prosta-5,13-dien-1-oate

: 64868-63-9
(5Z)-6,9-thiaprostacyclin

Guidance literature:: Multi-step reaction with 5 steps

1: 91 percent / tetrahydrofuran; acetic acid; H₂O / 12 h / 45 °C

2: 100 percent / sodium methoxyde / methanol / 1 h / Ambient temperature

3: potassium carbonate, iodine / CH₂Cl₂ / 3 h / -78 °C

4: 50 percent / 1,5-diazaabicyclo<5.4.0>undec-5-ene / benzene / 15 h / Ambient temperature

5: 55 percent / lithium hydroxide / tetrahydrofuran; H₂O / 12 h / Ambient temperature

With lithium hydroxide; iodine; sodium methylate; potassium carbonate; 1,5-Diazabicyclo[5.4.0]undec-5-ene; In tetrahydrofuran; methanol; dichloromethane; water; acetic acid; benzene;
DOI:10.1021/ja00402a036

Reference yield:

: 58073-79-3
(Z)-7-{(1R,2R,3R,5R)-5-Hydroxy-3-(tetrahydro-pyran-2-yloxy)-2-[(E)-(S)-3-(tetrahydro-pyran-2-yloxy)-oct-1-enyl]-cyclopentyl}-hept-5-enoic acid methyl ester

: 64868-63-9
(5Z)-6,9-thiaprostacyclin

Guidance literature:: Multi-step reaction with 7 steps

1: 93 percent / triethylamine / CH₂Cl₂ / 0.5 h / -20 °C

2: 93 percent / dimethylformamide / 15 h / 45 °C

3: 91 percent / tetrahydrofuran; acetic acid; H₂O / 12 h / 45 °C

4: 100 percent / sodium methoxyde / methanol / 1 h / Ambient temperature

5: potassium carbonate, iodine / CH₂Cl₂ / 3 h / -78 °C

6: 50 percent / 1,5-diazaabicyclo<5.4.0>undec-5-ene / benzene / 15 h / Ambient temperature

7: 55 percent / lithium hydroxide / tetrahydrofuran; H₂O / 12 h / Ambient temperature

With lithium hydroxide; iodine; sodium methylate; potassium carbonate; triethylamine; 1,5-Diazabicyclo[5.4.0]undec-5-ene; In tetrahydrofuran; methanol; dichloromethane; water; acetic acid; N,N-dimethyl-formamide; benzene;
DOI:10.1021/ja00402a036