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479353-63-4,MFCD04974012
Catalog No.:AA00I8NT

479353-63-4 | 4-(4-Carboxybenzyl)piperazine-1-carboxylic acid tert-butyl ester

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$27.00   $19.00
- +
1g
95%
in stock  
$62.00   $43.00
- +
5g
96%
in stock  
$253.00   $177.00
- +
10g
95%
in stock  
$316.00   $221.00
- +
25g
95%
in stock  
$655.00   $458.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00I8NT
Chemical Name:
4-(4-Carboxybenzyl)piperazine-1-carboxylic acid tert-butyl ester
CAS Number:
479353-63-4
Molecular Formula:
C17H24N2O4
Molecular Weight:
320.3835
MDL Number:
MFCD04974012
SMILES:
O=C(N1CCN(CC1)Cc1ccc(cc1)C(=O)O)OC(C)(C)C
Properties
Properties
 
BP:
452.6°C at 760 mmHg  
Form:
Solid  
MP:
196 C  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
417  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
5  
XLogP3:
-0.3  

Downstream Synthesis Route
914471-43-5    479353-63-4   
C27H27BrFN7O6 

[1]Patent:US2006/258719,2006,A1.Locationinpatent:Page/Pagecolumn33

[1]Patent:WO2012/161879,2012,A1.Locationinpatent:Page/Pagecolumn48-49

[1]Patent:US2013/102009,2013,A1.Locationinpatent:Paragraph0364-0366

[1]Patent:US2013/102009,2013,A1.Locationinpatent:Paragraph0372-0374

[1]Patent:WO2016/172528,2016,A1

[2]Patent:WO2018/81251,2018,A1

Literature
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SDS
Tags:479353-63-4 Molecular Formula|479353-63-4 MDL|479353-63-4 SMILES|479353-63-4 4-(4-Carboxybenzyl)piperazine-1-carboxylic acid tert-butyl ester |Heterocyclic_Building_Blocks