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Home Boronic Acids 1218791-38-8
1218791-38-8,MFCD13195756
Catalog No.:AA00168S

1218791-38-8 | 4-(4-Acetylpiperazino)phenylboronic acid, pinacol ester

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
98%
in stock  
$44.00   $31.00
- +
250mg
98%
in stock  
$71.00   $50.00
- +
1g
95%
in stock  
$191.00   $134.00
- +
5g
95%
in stock  
$572.00   $400.00
- +
10g
95%
in stock  
$953.00   $667.00
- +
25g
95%
in stock  
$1,905.00   $1,334.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00168S
Chemical Name:
4-(4-Acetylpiperazino)phenylboronic acid, pinacol ester
CAS Number:
1218791-38-8
Molecular Formula:
C18H27BN2O3
Molecular Weight:
330.2296
MDL Number:
MFCD13195756
SMILES:
CC(=O)N1CCN(CC1)c1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Properties
Properties
 
Form:
Solid  
Storage:
2-8℃;  

Computed Properties
 
Complexity:
451  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
4  
Rotatable Bond Count:
2  

Downstream Synthesis Route

[1]CurrentPatentAssignee:KIMBERLY-CLARKCORP;PFIZERINC-US2013/267493,2013,A1Locationinpatent:Paragraph1161;1162

[1]Patent:US2014/121200,2014,A1

[1]CurrentPatentAssignee:HUTCHISONCHINAMEDITECHLTD.-US2014/121200,2014,A1Locationinpatent:Paragraph0284;0285

591-50-4    1218791-38-8   
methyl5-(4-(pivaloyloxy)phenyl)pent-4-ynoate 
 
(E)-methyl5-(4-(4-acetylpiperazin-1-yl)phenyl)-4-phenyl-5-(4-(pivaloyloxy)phenyl)pent-4-enoate 

[1]Kim,Jina;Song,Jaeyoung;Ji,HyunDong;Yoo,EunKyung;Lee,Jae-Eon;Lee,SangBong;Oh,JiMin;Lee,Seungmi;Hwang,JiSun;Yoon,Heeseok;Kim,Dong-Su;Lee,Su-Jeong;Jeong,Minseon;Lee,Sungwoo;Kim,Kyung-Hee;Choi,Hueng-Sik;Lee,SangWoo;Park,Keun-Gyu;Lee,In-Kyu;Kim,SeongHeon;Hwang,Hayoung;Jeon,YongHyun;Chin,Jungwook;Cho,SungJin[JournalofMedicinalChemistry,2019,vol.62,#4,p.1837-1858]

Literature
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SDS
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Tags:1218791-38-8 Molecular Formula|1218791-38-8 MDL|1218791-38-8 SMILES|1218791-38-8 4-(4-Acetylpiperazino)phenylboronic acid, pinacol ester