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41513-02-4,MFCD00013871
Catalog No.:AA0071RV

41513-02-4 | 4-4-Bromo-2-(trifluoromethyl)phenyl isocyanate

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Technical Information
Catalog Number:
AA0071RV
Chemical Name:
4-4-Bromo-2-(trifluoromethyl)phenyl isocyanate
CAS Number:
41513-02-4
Molecular Formula:
C8H3BrF3NO
Molecular Weight:
266.0147
MDL Number:
MFCD00013871
SMILES:
O=C=Nc1ccc(cc1C(F)(F)F)Br
Properties
Computed Properties
 
Complexity:
250  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Rotatable Bond Count:
1  
XLogP3:
4.3  

Literature
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SDS
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Tags:41513-02-4 Molecular Formula|41513-02-4 MDL|41513-02-4 SMILES|41513-02-4 4-4-Bromo-2-(trifluoromethyl)phenyl isocyanate