CID 11735908

Base Information

Chemical Name:CID 11735908
CAS No.:483305-46-0
Molecular Formula:C₁₂H₁₄FNO
Molecular Weight:207.248
Hs Code.:
DSSTox Substance ID:DTXSID40471336
Nikkaji Number:J1.829.998D
Wikidata:Q82299829

Synonyms:483305-46-0;SCHEMBL6104351;DTXSID40471336;(3S)-3-[(4-FLUOROPHENYL)METHYL]PIPERIDIN-2-ONE

Suppliers and Price of CID 11735908

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
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price

Total 0 raw suppliers

Chemical Property of CID 11735908

Chemical Property:

XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:207.105942232
Heavy Atom Count:15
Complexity:224

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1CC(C(=O)NC1)CC2=CC=C(C=C2)F
Isomeric SMILES:C1C[C@H](C(=O)NC1)CC2=CC=C(C=C2)F

Technology Process of CID 11735908

There total 7 articles about CID 11735908 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:

: 483305-37-9
(E)-3-(4-fluorobenzylidene)piperidin-2-one

: (R)-3-(4-fluorobenzyl)-2-piperidone

: 483305-46-0
(S)-3-(4-fluorobenzyl)-2-piperidone

Guidance literature:: With [(S,S)-(BDPP)Ir(COD)]BF₄; hydrogen; In methanol; dichloromethane; at 20 ℃; for 24h; under 3361.55 Torr; Title compound not separated from byproducts.;
DOI:10.1021/ja028043y

Reference yield:

: 675-20-7
piperidin-2-one

: 483305-46-0
(S)-3-(4-fluorobenzyl)-2-piperidone

Guidance literature:: Multi-step reaction with 3 steps

1: toluene / 0.5 h / 25 °C

2: 24.8 g / KO(t-Bu) / tetrahydrofuran / 1 h / 55 °C

3: H₂; [(S,S)-(BDPP)Ir(COD)]BF₄ / methanol; CH₂Cl₂ / 24 h / 20 °C / 3361.55 Torr

With [(S,S)-(BDPP)Ir(COD)]BF₄; potassium tert-butylate; hydrogen; In tetrahydrofuran; methanol; dichloromethane; toluene;
DOI:10.1021/ja028043y

Reference yield:

: 459-57-4
4-fluorobenzaldehyde

: 483305-46-0
(S)-3-(4-fluorobenzyl)-2-piperidone

Guidance literature:: Multi-step reaction with 2 steps

1: 24.8 g / KO(t-Bu) / tetrahydrofuran / 1 h / 55 °C

2: H₂; [(S,S)-(BDPP)Ir(COD)]BF₄ / methanol; CH₂Cl₂ / 24 h / 20 °C / 3361.55 Torr

With [(S,S)-(BDPP)Ir(COD)]BF₄; potassium tert-butylate; hydrogen; In tetrahydrofuran; methanol; dichloromethane;
DOI:10.1021/ja028043y