Home Nitriles 2-Bromo-4-(trifluoromethoxy)benzonitrile

2-Bromo-4-(trifluoromethoxy)benzonitrile

CAS No.:
1214334-83-4
Catalog Number:
AG0014SV
Molecular Formula:
C8H3BrF3NO
Molecular Weight:
266.0147
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
95%
In Stock USA
United States
$207
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Product Description
Catalog Number:
AG0014SV
Chemical Name:
2-Bromo-4-(trifluoromethoxy)benzonitrile
CAS Number:
1214334-83-4
Molecular Formula:
C8H3BrF3NO
Molecular Weight:
266.0147
MDL Number:
MFCD13185874
IUPAC Name:
2-bromo-4-(trifluoromethoxy)benzonitrile
InChI:
InChI=1S/C8H3BrF3NO/c9-7-3-6(14-8(10,11)12)2-1-5(7)4-13/h1-3H
InChI Key:
KQXCJMGFMNVWGL-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1Br)OC(F)(F)F
Properties
Complexity:
247  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.935g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.017g/mol
Monoisotopic Mass:
264.935g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties