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50288-62-5
Catalog No.:AA00DDH3

50288-62-5 | (D,L)-threo-α-Phenyl-

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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA00DDH3
Chemical Name:
(D,L)-threo-α-Phenyl-
CAS Number:
50288-62-5
Molecular Formula:
C13H18N2O
Molecular Weight:
218.2948
SMILES:
C1CCNC(C1)C(C2=CC=CC=C2)C(=O)N
Properties
Computed Properties
 
Complexity:
236  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
3  
XLogP3:
-0.8  

Literature

Title: Quantitative structure-activity relationship studies of threo-methylphenidate analogs.

Journal: Bioorganic & medicinal chemistry 20101015

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Tags:50288-62-5 Molecular Formula|50288-62-5 MDL|50288-62-5 SMILES|50288-62-5 (D,L)-threo-α-Phenyl-