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Home Fluorides 948018-61-9
948018-61-9,MFCD12198414
Catalog No.:AA003H6A

948018-61-9 | 2-Fluoro-4-(4-methyl-1-piperazinyl)benzoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
97%
in stock  
$145.00   $102.00
- +
1g
97%
in stock  
$344.00   $241.00
- +
5g
97%
in stock  
$1,208.00   $846.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003H6A
Chemical Name:
2-Fluoro-4-(4-methyl-1-piperazinyl)benzoic acid
CAS Number:
948018-61-9
Molecular Formula:
C12H15FN2O2
Molecular Weight:
238.2581
MDL Number:
MFCD12198414
SMILES:
CN1CCN(CC1)c1ccc(c(c1)F)C(=O)O
Properties
Properties
 
Storage:
Room Temperature;  

Computed Properties
 
Complexity:
280  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
-0.8  

Downstream Synthesis Route

[1]CurrentPatentAssignee:NERVIANOMEDICALSCIENCESS.R.L.-WO2007/68619,2007,A1Locationinpatent:Page/Pagecolumn98

[2]CurrentPatentAssignee:NERVIANOMEDICALSCIENCESS.R.L.-WO2007/99171,2007,A2Locationinpatent:Page/Pagecolumn54

948018-61-9    1257211-58-7   
tert-butyl6-bromo-3-(2-fluoro-4-(4-methylpiperazin-1-yl)benzamido)-1H-indazole-1-carboxylate 

[1]Cui,Jing;Peng,Xia;Gao,Dingding;Dai,Yang;Ai,Jing;Li,Yingxia[BioorganicandMedicinalChemistryLetters,2017,vol.27,#16,p.3782-3786]

Literature
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SDS
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Tags:948018-61-9 Molecular Formula|948018-61-9 MDL|948018-61-9 SMILES|948018-61-9 2-Fluoro-4-(4-methyl-1-piperazinyl)benzoic acid