3-Nortropanone

Base Information

• Chemical Name: 3-Nortropanone
• CAS No.: 5632-84-8
• Molecular Formula: C7H11NO
• Molecular Weight: 125.17
• Hs Code.: 2933990090
• UNII: 319YZ5SG0N
• Nikkaji Number: J1.463.991H
• Wikidata: Q27256035
• Mol file: 5632-84-8.mol

Synonyms:nortropan-3-one;3-nortropanone;Nortropinone;(1R,5S)-8-Azabicyclo[3.2.1]octan-3-one;319YZ5SG0N;NSC-351100;UNII-319YZ5SG0N;1alphaH,5alphaH-Nortropan-3-one;(1S,5R)-8-azabicyclo[3.2.1]octan-3-one;AMY581;SCHEMBL3331350;AKOS006282530;CS-0183311;1.ALPHA.H,5.ALPHA.H-NORTROPAN-3-ONE;EN300-370827;Q27256035

Chemical Property of 3-Nortropanone

Chemical Property:

• Vapor Pressure: 1.36E-10mmHg at 25°C
• Refractive Index: 1.572
• Boiling Point: 221.4 °C at 760 mmHg
• PKA: 9.15±0.20(Predicted)
• Flash Point: 104.3 °C
• PSA: 29.10000
• Density: 1.083 g/cm³
• LogP: 0.79870
• XLogP3: -0.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 125.084063974
• Heavy Atom Count: 9
• Complexity: 130

Purity/Quality:

99%, ^*data from raw suppliers

(1R,5S)-8-Azabicyclo[3.2.1]octan-3-one 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC2CC(=O)CC1N2
• Isomeric SMILES: C1C[C@H]2CC(=O)C[C@@H]1N2

Technology Process of 3-Nortropanone

There total 30 articles about 3-Nortropanone 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: 100.0%

tropinone (532-24-1) → nortropinone (5632-84-8)

Guidance literature:

tropinone; With carbonochloridic acid 1-chloro-ethyl ester; In 1,2-dichloro-ethane; for 3h; Heating;

In methanol; for 5h; Heating;

DOI:10.1016/S0040-4020(02)00530-6

Reference yield: 100.0%

Boc-tropinone (185099-67-6) → nortropinone (5632-84-8)

Guidance literature:

With hydrogenchloride; In 1,4-dioxane; water; at 25 ℃; for 2h;

Reference yield: 100.0%

(8-azabicyclo[3.2.1]octan-3-one) hydrochloride → 8-azabicyclo[3.2.1]octan-3-one (5632-84-8)

Guidance literature:

With sodium hydroxide; In water; at 0 - 20 ℃;

DOI:10.1021/acsmedchemlett.6b00186

upstream raw materials:

2,2,2-trichlorocarboxynortropinone

tropinone

8-(phenyloxycarbonyl)-8-azabicyclo<3.2.1>octan-3-one

N-carbethoxytropinone

Downstream raw materials:

3-phenyl-8-aza-bicyclo[3.2.1]octan-3-ol

3-(2-methoxyphenyl)-8-propyl-8-azabicyclo[3.2.1]octan-3-endo-ol

(1S,3R,5R)-3-(3-Trifluoromethyl-phenyl)-8-aza-bicyclo[3.2.1]octan-3-ol

(1S,3R,5R)-3-Benzo[b]thiophen-3-yl-8-benzyl-8-aza-bicyclo[3.2.1]octan-3-ol

Refernces

• 1、 -. "CHROMEN-4-ONE DERIVATIVES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS DISEASE". Page/Page column 80; 81. . Retrieved 2020/05/21.
• 2、 Salunke, Ramkrushna Ashok,Sidhu, Chandni,Kumar, Ashok,Pinnaka, Anil Kumar,Bansal, Baldev Raj,Chhibber, Manmohan. "Enhanced antibacterial activity of endo-nortropine substituted (C-7) fluoroquinolones against V. cholerae, S. aureus and B. subtilis". . p. 895 - 904. Retrieved 2018/09/10.