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Home Fluorides 302912-19-2
302912-19-2,MFCD01863577
Catalog No.:AA002ZFS

302912-19-2 | 3-Fluoro-5-(trifluoromethyl)phenyl isocyanate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$79.00   $55.00
- +
1g
95%
in stock  
$211.00   $148.00
- +
5g
95%
in stock  
$667.00   $467.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA002ZFS
Chemical Name:
3-Fluoro-5-(trifluoromethyl)phenyl isocyanate
CAS Number:
302912-19-2
Molecular Formula:
C8H3F4NO
Molecular Weight:
205.1091
MDL Number:
MFCD01863577
SMILES:
O=C=Nc1cc(F)cc(c1)C(F)(F)F
Properties
Properties
 
Form:
Liquid  

Computed Properties
 
Complexity:
246  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
6  
Rotatable Bond Count:
1  
XLogP3:
3.7  

Downstream Synthesis Route
605661-13-0    302912-19-2   
N-4-(4-amino-6-methylthieno2,3-dpyrimidin-5-yl)phenyl-N'-3-fluoro-5-(trifluoromethyl)phenylurea 

[1]CurrentPatentAssignee:ABBVIEINC-US2003/225273,2003,A1Locationinpatent:Page19

[1]CurrentPatentAssignee:PFIZERINC-EP1183229,2005,B1Locationinpatent:Page/Pagecolumn157;158

[1]Patent:US6503949,2003,B1

[2]Patent:EP1183229,2005,B1.Locationinpatent:Page/Pagecolumn158

302912-19-2    393-36-2   
1-(3-fluoro-5-trifluoromethyl-phenyl)-3-(4-bromo-3-trifluoromethyl-phenyl)-urea 

[1]Patent:WO2007/68395,2007,A1.Locationinpatent:Page/Pagecolumn7

[2]Patent:US2009/5452,2009,A1.Locationinpatent:Page/Pagecolumn3

[1]Watson,RobertJ.;Allen,DanielR.;Birch,HelenL.;Chapman,GayleA.;Hannah,DuncanR.;Knight,RolandL.;Meissner,JohannesW.G.;Owen,DavidA.;Thomas,ElizabethJ.[BioorganicandMedicinalChemistryLetters,2007,vol.17,#24,p.6806-6810]

Literature
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SDS
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Tags:302912-19-2 Molecular Formula|302912-19-2 MDL|302912-19-2 SMILES|302912-19-2 3-Fluoro-5-(trifluoromethyl)phenyl isocyanate