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519151-74-7,MFCD03479904
Catalog No.:AA00DBC3

519151-74-7 | 1-(4-FLUORO-PHENYL)-2,5-DIMETHYL-1H-PYRROLE-3-CARBOXYLIC ACID

Pack Size
Purity
Availability
Price(USD)
Quantity
  
50mg
95%
3 weeks  
$217.00   $152.00
- +
100mg
95%
3 weeks  
$265.00   $185.00
- +
250mg
95%
3 weeks  
$329.00   $230.00
- +
500mg
95%
3 weeks  
$450.00   $315.00
- +
1g
95%
3 weeks  
$545.00   $382.00
- +
2.5g
95%
3 weeks  
$965.00   $675.00
- +
5g
95%
3 weeks  
$1,368.00   $958.00
- +
10g
95%
3 weeks  
$1,977.00   $1,384.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00DBC3
Chemical Name:
1-(4-FLUORO-PHENYL)-2,5-DIMETHYL-1H-PYRROLE-3-CARBOXYLIC ACID
CAS Number:
519151-74-7
Molecular Formula:
C13H12FNO2
Molecular Weight:
233.2383
MDL Number:
MFCD03479904
SMILES:
Fc1ccc(cc1)n1c(C)cc(c1C)C(=O)O
Properties
Computed Properties
 
Complexity:
289  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
2.7  

Downstream Synthesis Route
519151-74-7   
4-(aminomethyl)benzamidinehydrochloride 
  1312604-20-8 

[1]CurrentPatentAssignee:ACTIVESITEPHARMACEUTICALS-US2011/152533,2011,A1Locationinpatent:Page/Pagecolumn14;15

[1]CurrentPatentAssignee:ACTIVESITEPHARMACEUTICALS-US2012/264798,2012,A1Locationinpatent:Page/Pagecolumn10

[1]Mahy,William;Patel,Mikesh;Steadman,David;Woodward,HannahL.;Atkinson,BenjaminN.;Svensson,Fredrik;Willis,NickyJ.;Flint,Alister;Papatheodorou,Dimitra;Zhao,Yuguang;Vecchia,Luca;Ruza,ReinisR.;Hillier,James;Frew,Sarah;Monaghan,Amy;Costa,Artur;Bictash,Magda;Walter,MagnusW.;Jones,E.Yvonne;Fish,PaulV.[JournalofMedicinalChemistry,2020,vol.63,#17,p.9464-9483]

Literature
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SDS
Tags:519151-74-7 Molecular Formula|519151-74-7 MDL|519151-74-7 SMILES|519151-74-7 1-(4-FLUORO-PHENYL)-2,5-DIMETHYL-1H-PYRROLE-3-CARBOXYLIC ACID