Pulo'upone

Base Information

• Chemical Name: Pulo'upone
• CAS No.: 97190-30-2
• Molecular Formula: C₂₁H₂₇NO
• Molecular Weight: 309.451
• Wikidata: Q105278194
• Metabolomics Workbench ID: 170321
• Mol file: 97190-30-2.mol

Synonyms:pulo'upone

Chemical Property of Pulo'upone

Chemical Property:

• Vapor Pressure: 7.01E-08mmHg at 25°C
• Boiling Point: 438.2°Cat760mmHg
• Flash Point: 223.9°C
• Density: 1.031g/cm³
• XLogP3: 4.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 6
• Exact Mass: 309.209264485
• Heavy Atom Count: 23
• Complexity: 453

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(=O)C1C2CCCC2C=CC1CCC=CCC3=CC=CC=N3
• Isomeric SMILES: CC(=O)[C@H]1[C@@H]2CCC[C@H]2C=C[C@H]1CC/C=C/CC3=CC=CC=N3

Technology Process of Pulo'upone

There total 43 articles about Pulo'upone 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:

(2E,4E,8E)-10-Pyridin-2-yl-deca-2,4,8-trien-1-ol (153432-18-9) → (+/-)-Pulo'upone (97190-30-2,119650-31-6,120442-04-8,123807-89-6,123807-91-0)

Guidance literature:

Multi-step reaction with 5 steps

1: 95 percent / pyridine

2: 55 percent / dilithium tetrachlorocuprate / tetrahydrofuran / 3 h / -30 °C

3: 95 percent / 10percent H₂SO₄ / acetone

4: 70 percent / K₂CO₃ / dioxane; H₂O / 95 °C

5: toluene / 48 h / 110 °C / sealed ampoule

With pyridine; sulfuric acid; potassium carbonate; dilithium tetrachlorocuprate; In tetrahydrofuran; 1,4-dioxane; water; acetone; toluene;

DOI:10.1016/S0040-4020(01)88024-8

Reference yield:

10-(2-pyridyl)-2E,4E,8E-decatrien-1-ol acetate (153432-19-0) → (+/-)-Pulo'upone (97190-30-2,119650-31-6,120442-04-8,123807-89-6,123807-91-0)

Guidance literature:

Multi-step reaction with 4 steps

1: 55 percent / dilithium tetrachlorocuprate / tetrahydrofuran / 3 h / -30 °C

2: 95 percent / 10percent H₂SO₄ / acetone

3: 70 percent / K₂CO₃ / dioxane; H₂O / 95 °C

4: toluene / 48 h / 110 °C / sealed ampoule

With sulfuric acid; potassium carbonate; dilithium tetrachlorocuprate; In tetrahydrofuran; 1,4-dioxane; water; acetone; toluene;

DOI:10.1016/S0040-4020(01)88024-8

Reference yield:

ethyl 10-(2-pyridyl)-2E,4E,8E-decatrienoate (153432-16-7) → (+/-)-Pulo'upone (97190-30-2,119650-31-6,120442-04-8,123807-89-6,123807-91-0)

Guidance literature:

Multi-step reaction with 6 steps

1: 88 percent / LiAlH₄ / diethyl ether / 1 h / -30 °C

2: 95 percent / pyridine

3: 55 percent / dilithium tetrachlorocuprate / tetrahydrofuran / 3 h / -30 °C

4: 95 percent / 10percent H₂SO₄ / acetone

5: 70 percent / K₂CO₃ / dioxane; H₂O / 95 °C

6: toluene / 48 h / 110 °C / sealed ampoule

With pyridine; lithium aluminium tetrahydride; sulfuric acid; potassium carbonate; dilithium tetrachlorocuprate; In tetrahydrofuran; 1,4-dioxane; diethyl ether; water; acetone; toluene;

DOI:10.1016/S0040-4020(01)88024-8

upstream raw materials:

α-picoline

1-[(3aR,4R,5R,7aS)-5-((E)-4-Iodo-but-3-enyl)-2,3,3a,4,5,7a-hexahydro-1H-inden-4-yl]-ethanol

16-(2-pyridyl)-3E,8E,10E,14E-hexadecatetraen-2-one

(2E,4E,8E)-10-Pyridin-2-yl-deca-2,4,8-trien-1-ol