8-AZABICYCLO(3.2.1)OCTANE-2-CARBOXYLIC ACID, 3-(4-FLUOROPHENYL)-8-(2-PROPENYL)-, METHYL ESTER, (R-(EXO, EXO))-

Base Information

• Chemical Name: 8-AZABICYCLO(3.2.1)OCTANE-2-CARBOXYLIC ACID, 3-(4-FLUOROPHENYL)-8-(2-PROPENYL)-, METHYL ESTER, (R-(EXO, EXO))-
• CAS No.: 127648-29-7
• Molecular Formula: C18H22 F N O2
• Molecular Weight: 303.377
• Mol file: 127648-29-7.mol

Synonyms:8-Azabicyclo[3.2.1]octane-2-carboxylicacid, 3-(4-fluorophenyl)-8-(2-propenyl)-, methyl ester, (1R,2S,3S,5S)- (9CI);8-Azabicyclo[3.2.1]octane-2-carboxylic acid,3-(4-fluorophenyl)-8-(2-propenyl)-, methyl ester, [1R-(exo,exo)]-

Chemical Property of 8-AZABICYCLO(3.2.1)OCTANE-2-CARBOXYLIC ACID, 3-(4-FLUOROPHENYL)-8-(2-PROPENYL)-, METHYL ESTER, (R-(EXO, EXO))-

Chemical Property:

• Vapor Pressure: 7.08E-06mmHg at 25°C
• Boiling Point: 376.8°C at 760 mmHg
• Flash Point: 181.7°C
• PSA: 29.54000
• Density: 1.126g/cm³
• LogP: 3.05910

Purity/Quality:

99% ，98% ^*data from raw suppliers

(1R,2S,3S,5S)-METHYL 8-ALLYL-3-(4-FLUOROPHENYL)-8-AZABICYCLO[3.2.1]OCTANE-2-CARBOXYLATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 8-AZABICYCLO(3.2.1)OCTANE-2-CARBOXYLIC ACID, 3-(4-FLUOROPHENYL)-8-(2-PROPENYL)-, METHYL ESTER, (R-(EXO, EXO))-

There total 5 articles about 8-AZABICYCLO(3.2.1)OCTANE-2-CARBOXYLIC ACID, 3-(4-FLUOROPHENYL)-8-(2-PROPENYL)-, METHYL ESTER, (R-(EXO, EXO))- 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: 47.0%

2β-carbomethoxy-3β-(4-fluorophenyl)-8-azabicyclo[3.2.1]octane (127648-30-0,131488-15-8) + allyl bromide (106-95-6) → 2β-carbomethoxy-3β-(4-fluorophenyl)-8-allylnortropane (127648-29-7)

Guidance literature:

With potassium iodide; In ethanol; for 16h; Ambient temperature;

DOI:10.1021/jm00109a029

Reference yield:

2β-carbomethoxy-3β-(4-fluorophenyl)tropane (50370-59-7) → 2β-carbomethoxy-3β-(4-fluorophenyl)-8-allylnortropane (127648-29-7)

Guidance literature:

Multi-step reaction with 3 steps

1: toluene / 1 h / 120 °C

2: 50percent aq. CH₃COOH, Zn / 16 h / Ambient temperature

3: 47 percent / KI / ethanol / 16 h / Ambient temperature

With acetic acid; potassium iodide; zinc; In ethanol; toluene;

DOI:10.1021/jm00109a029

Reference yield:

methyl ecgonidine (50373-10-9) → 2β-carbomethoxy-3β-(4-fluorophenyl)-8-allylnortropane (127648-29-7)

Guidance literature:

Multi-step reaction with 4 steps

1: 11 percent / diethyl ether / 1 h / -20 °C

2: toluene / 1 h / 120 °C

3: 50percent aq. CH₃COOH, Zn / 16 h / Ambient temperature

4: 47 percent / KI / ethanol / 16 h / Ambient temperature

With acetic acid; potassium iodide; zinc; In diethyl ether; ethanol; toluene;

DOI:10.1021/jm00109a029

upstream raw materials:

2β-carbomethoxy-3β-(4-fluorophenyl)-8-azabicyclo[3.2.1]octane

allyl bromide

N-(2,2,2-trichloroethylcarbamoyl)-2β-carbomethoxy-3β-(4'-fluorophenyl)nortropane

2β-carbomethoxy-3β-(4-fluorophenyl)tropane

Downstream raw materials:

2β-carbomethoxy-3β-(4-fluorophenyl)-8-propylnortropane

Refernces