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AD45198

109887-53-8 | (+/-)-Trans-4-(fluorophenyl)-3-hydroxymethyl-1-methylpiperidine

Packsize Purity Availability Price Discounted Price    Quantity
5g 95% in stock $103.00 $72.00 -   +
25g 95% in stock $275.00 $192.00 -   +

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Description
Catalog Number: AD45198
Chemical Name: (+/-)-Trans-4-(fluorophenyl)-3-hydroxymethyl-1-methylpiperidine
CAS Number: 109887-53-8
Molecular Formula: C13H18FNO
Molecular Weight: 223.2865
MDL Number: MFCD02093092
SMILES: OC[C@H]1CN(C)CC[C@@H]1c1ccc(cc1)F

 

Computed Properties
Complexity: 216  
Covalently-Bonded Unit Count: 1  
Heavy Atom Count: 16  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 1  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 2  
XLogP3: 1.8  

 

 

Upstream Synthesis Route 
  • The compound ((3R,4S)-rel-4-(4-Fluorophenyl)-1-methylpiperidin-3-yl)methanol is a valuable building block in chemical synthesis. It can be utilized as a chiral auxiliary in asymmetric synthesis reactions to introduce stereochemical control in the formation of new carbon-carbon or carbon-heteroatom bonds. By incorporating this compound into the synthesis of complex molecules, chemists can efficiently access enantiopure products with specific three-dimensional orientations. Additionally, the presence of a fluorine substituent on the phenyl ring provides opportunities for further functionalization through various chemical transformations, enabling the creation of diverse molecular structures with tailored properties.
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