Home Fluorides 10540-45-1
10540-45-1,MFCD03424674
Catalog No.:AA008S9N

10540-45-1 | 3-(4-Fluorophenyl)aniline

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Purity
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1g
95%
in stock  
$211.00   $148.00
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5g
95%
in stock  
$610.00   $427.00
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10g
95%
in stock  
$1,009.00   $706.00
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25g
95%
in stock  
$2,007.00   $1,405.00
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  • Technical Information
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  • Downstream Synthesis Route
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA008S9N
Chemical Name:
3-(4-Fluorophenyl)aniline
CAS Number:
10540-45-1
Molecular Formula:
C12H10FN
Molecular Weight:
187.2129
MDL Number:
MFCD03424674
SMILES:
Fc1ccc(cc1)c1cccc(c1)N
Properties
Computed Properties
 
Complexity:
175  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
3  

Downstream Synthesis Route
3-(4-Fluoro-phenyl)-cyclohex-2-enoneoxime 
  10540-45-1 

[1]Matsumoto;Tomizuka;Suzuki[SyntheticCommunications,1994,vol.24,#10,p.1441-1446]

[1]Dewar,M.J.S.;Marchand,A.P.[JournaloftheAmericanChemicalSociety,1966,vol.88,#14,p.3318-3327]

[1]Pollack,ScottJ.;Beyer,KimS.;Lock,Christopher;Mueller,Ilka;Sheppard,David;Lipkin,Mike;Hardick,David;Blurton,Peter;Leonard,PhilipM.;Hubbard,PaulA.;Todd,Daniel;Richardson,ChristineM.;Ahrens,Thomas;Baader,Manuel;Hafenbradl,DorisO.;Hilyard,Kate;Buerli,RolandW.[JournalofComputer-AidedMolecularDesign,2011,vol.25,#7,p.677-687]

[1]Locationinpatent:schemeortablePollack,ScottJ.;Beyer,KimS.;Lock,Christopher;Mueller,Ilka;Sheppard,David;Lipkin,Mike;Hardick,David;Blurton,Peter;Leonard,PhilipM.;Hubbard,PaulA.;Todd,Daniel;Richardson,ChristineM.;Ahrens,Thomas;Baader,Manuel;Hafenbradl,DorisO.;Hilyard,Kate;Buerli,RolandW.[JournalofComputer-AidedMolecularDesign,2011,vol.25,#7,p.677-687]

[1]Hoggard,LoganR.;Zhang,Yongqiang;Zhang,Min;Panic,Vanja;Wisniewski,JohnA.;Ji,Haitao[JournaloftheAmericanChemicalSociety,2015,vol.137,#38,p.12249-12260]

[2]CurrentPatentAssignee:UNIVERSITYOFUTAH-WO2016/168524,2016,A1Locationinpatent:Paragraph00318;00319

[3]Lacivita,Enza;Patarnello,Daniela;Stroth,Nikolas;Caroli,Antonia;Niso,Mauro;Contino,Marialessandra;DeGiorgio,Paola;DiPilato,Pantaleo;Colabufo,NicolaA.;Berardi,Francesco;Perrone,Roberto;Svenningsson,Per;Hedlund,PeterB.;Leopoldo,Marcello[JournalofMedicinalChemistry,2012,vol.55,#14,p.6375-6380]

[4]Tang,Jing;Liu,Feng;Nagy,Eva;Miller,Lena;Kirby,KarenA.;Wilson,DanielJ.;Wu,Bulan;Sarafianos,StefanG.;Parniak,MichaelA.;Wang,Zhengqiang[JournalofMedicinalChemistry,2016,vol.59,#6,p.2648-2659]

Literature
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Tags:10540-45-1 Molecular Formula|10540-45-1 MDL|10540-45-1 SMILES|10540-45-1 3-(4-Fluorophenyl)aniline