Home Amines 247071-37-0
247071-37-0,MFCD20696930
Catalog No.:AA00BJ4O

247071-37-0 | 4-AMino-5-fluoro-2-Methoxy-benzonitrile

Pack Size
Purity
Availability
Price(USD)
Quantity
  
500mg
97%
in stock  
$449.00   $314.00
- +
1g
97%
in stock  
$627.00   $439.00
- +
5g
97%
in stock  
$1,975.00   $1,383.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00BJ4O
Chemical Name:
4-AMino-5-fluoro-2-Methoxy-benzonitrile
CAS Number:
247071-37-0
Molecular Formula:
C8H7FN2O
Molecular Weight:
166.1524
MDL Number:
MFCD20696930
SMILES:
COc1cc(N)c(cc1C#N)F
Properties
Computed Properties
 
Complexity:
201  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
1  

Downstream Synthesis Route

[1]Estrada,AnthonyA.;Liu,Xingrong;Baker-Glenn,Charles;Beresford,Alan;Burdick,DanielJ.;Chambers,Mark;Chan,BryanK.;Chen,Huifen;Ding,Xiao;Dipasquale,AntonioG.;Dominguez,SaraL.;Dotson,Jennafer;Drummond,Jason;Flagella,Michael;Flynn,Sean;Fuji,Reina;Gill,Andrew;Gunzner-Toste,Janet;Harris,SethF.;Heffron,TimothyP.;Kleinheinz,Tracy;Lee,DonnaW.;LePichon,ClaireE.;Lyssikatos,JosephP.;Medhurst,AndrewD.;Moffat,JohnG.;Mukund,Susmith;Nash,Kevin;Scearce-Levie,Kimberly;Sheng,Zejuan;Shore,DanielG.;Tran,Thuy;Trivedi,Naimisha;Wang,Shumei;Zhang,Shuo;Zhang,Xiaolin;Zhao,Guiling;Zhu,Haitao;Sweeney,ZacharyK.[JournalofMedicinalChemistry,2012,vol.55,#22,p.9416-9433]

[2]CurrentPatentAssignee:7TMPHARMAAS-WO2004/48319,2004,A1Locationinpatent:Page67

[3]CurrentPatentAssignee:7TMPHARMAAS-WO2003/87045,2003,A1Locationinpatent:Page/Pagecolumn110

[4]CurrentPatentAssignee:ALMIRALLSA-WO2011/141180,2011,A1Locationinpatent:Page/Pagecolumn58

Literature
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SDS
Tags:247071-37-0 Molecular Formula|247071-37-0 MDL|247071-37-0 SMILES|247071-37-0 4-AMino-5-fluoro-2-Methoxy-benzonitrile