Pseudocarene, (+)-

Base Information

• Chemical Name: Pseudocarene, (+)-
• CAS No.: 6909-01-9
• Molecular Formula: C₁₀H₁₆
• Molecular Weight: 136.237
• UNII: 6F93WO1GUS
• Nikkaji Number: J918.431G
• Wikidata: Q27895923
• Mol file: 6909-01-9.mol

Synonyms:Pseudocarene, (+)-;6F93WO1GUS;(+)-3(10)-Carene;3(10)-Carene, (1S,6R)-(+)-;Bicyclo(4.1.0)heptane, 7,7-dimethyl-3-methylene-, (1S)-;6909-01-9;(+)-pseudocarene;UNII-6F93WO1GUS;Q27895923;(1S,6R)-7,7-Dimethyl-3-methylenebicyclo[4.1.0]heptane

Chemical Property of Pseudocarene, (+)-

Chemical Property:

• XLogP3: 3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 136.125200510
• Heavy Atom Count: 10
• Complexity: 177

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1(C2C1CC(=C)CC2)C
• Isomeric SMILES: CC1([C@H]2[C@@H]1CC(=C)CC2)C

Technology Process of Pseudocarene, (+)-

There total 1 articles about Pseudocarene, (+)- 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:

2-carene (4497-92-1) → (+)-Δ3-carene (498-15-7,19079-29-9) + β-carene (6909-01-9)

Guidance literature:

With [(trimethylsilyl)methyl]potassium; diethylchloroborane; water; Yield given. Multistep reaction. Yields of byproduct given;

DOI:10.1016/S0957-4166(97)00589-2

Reference yield:

β-carene (6909-01-9) → (+)-(1R,6R)-3-(((trifluoromethyl)sulfonyl)oxy)-7,7-dimethylbicyclo<4.1.0>hept-2-ene (124719-15-9)

Guidance literature:

Multi-step reaction with 2 steps

1: 1) O₃ 2) Zn, AcOH / 1) CH₂Cl₂, MeOH, -78 deg C, 30 min, 2) a) -78 deg C, 30 min, b) r.t, 1h

2: 55 percent / tetrahydrofuran / 1) -78 deg C, 10 min, 2) 0 deg C, 3h

With ozone; acetic acid; zinc; In tetrahydrofuran;

DOI:10.1021/jo00292a039

upstream raw materials:

2-carene

Downstream raw materials:

(+)-(1R,6R)-3-(((trifluoromethyl)sulfonyl)oxy)-7,7-dimethylbicyclo<4.1.0>hept-2-ene