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139057-86-6,MFCD00673072
Catalog No.:AA001A0K

139057-86-6 | 4-Fluoro-3-(trifluoromethyl)phenyl isocyanate

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1g
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Technical Information
Catalog Number:
AA001A0K
Chemical Name:
4-Fluoro-3-(trifluoromethyl)phenyl isocyanate
CAS Number:
139057-86-6
Molecular Formula:
C8H3F4NO
Molecular Weight:
205.1091
MDL Number:
MFCD00673072
SMILES:
O=C=Nc1ccc(c(c1)C(F)(F)F)F
Properties
Properties
 
BP:
48 °C1 mm Hg(lit.)  
Form:
Liquid  
Refractive Index:
n20/D 1.461(lit.)  

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  

Literature
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SDS
Tags:139057-86-6 Molecular Formula|139057-86-6 MDL|139057-86-6 SMILES|139057-86-6 4-Fluoro-3-(trifluoromethyl)phenyl isocyanate |Halogenated_Heterocycles