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119929-87-2,MFCD05668053
Catalog No.:AA000PSP

119929-87-2 | (4-Benzyl-piperazin-1-yl)-acetic acid

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Purity
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1g
95%
in stock  
$2,379.00   $1,665.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA000PSP
Chemical Name:
(4-Benzyl-piperazin-1-yl)-acetic acid
CAS Number:
119929-87-2
Molecular Formula:
C13H18N2O2
Molecular Weight:
234.2942
MDL Number:
MFCD05668053
SMILES:
OC(=O)CN1CCN(CC1)Cc1ccccc1
Properties
Computed Properties
 
Complexity:
244  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
4  
XLogP3:
-1.1  

Downstream Synthesis Route

[1]CurrentPatentAssignee:C.H.BoehringerSohnAG&Co.KG-US5994356,1999,A

[1]CurrentPatentAssignee:UNIVERSITYOFILLINOIS(SYSTEM)-WO2008/134474,2008,A2Locationinpatent:Page/Pagecolumn73

[2]CurrentPatentAssignee:UNIVERSITYOFILLINOIS(SYSTEM)-WO2010/91382,2010,A1Locationinpatent:Page/Pagecolumn33

Literature
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SDS
Tags:119929-87-2 Molecular Formula|119929-87-2 MDL|119929-87-2 SMILES|119929-87-2 (4-Benzyl-piperazin-1-yl)-acetic acid