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2285-12-3,MFCD00002008
Catalog No.:AA003F2Z

2285-12-3 | 2-(TRIFLUOROMETHYL)PHENYL ISOCYANATE

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1g
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003F2Z
Chemical Name:
2-(TRIFLUOROMETHYL)PHENYL ISOCYANATE
CAS Number:
2285-12-3
Molecular Formula:
C8H4F3NO
Molecular Weight:
187.1187
MDL Number:
MFCD00002008
SMILES:
O=C=Nc1ccccc1C(F)(F)F
Properties
Properties
 
Form:
Liquid  
Storage:
Inert atmosphere;2-8℃;  

Computed Properties
 
Complexity:
220  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Rotatable Bond Count:
1  
XLogP3:
3.6  

Downstream Synthesis Route

[1]JournalofMedicinalChemistry,1980,vol.23,p.857-861

[2]Patent:US4073790,1978,A

[1]Richter,Monika;Richter,Wolfgang;Pallas,Manfred[ZeitschriftfurChemie,1989,vol.29,#6,p.204-205]

40835-96-9    2285-12-3   
1-(1H-Perimidin-2-yl)-3-(2-trifluoromethyl-phenyl)-urea 

[1]ArchivderPharmazie,1988,vol.321,p.425-426

[1]JournalofHeterocyclicChemistry,1983,vol.20,p.331-336

[1]JournalofMedicinalChemistry,1998,vol.41,p.4301-4308

Literature
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SDS
Tags:2285-12-3 Molecular Formula|2285-12-3 MDL|2285-12-3 SMILES|2285-12-3 2-(TRIFLUOROMETHYL)PHENYL ISOCYANATE |Fluorinated_Building_Blocks