Home Halogens 2-Bromo-5-(cyanomethyl)benzotrifluoride

2-Bromo-5-(cyanomethyl)benzotrifluoride

CAS No.:
1159512-69-2
Catalog Number:
AG009LV1
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG009LV1
Chemical Name:
2-Bromo-5-(cyanomethyl)benzotrifluoride
CAS Number:
1159512-69-2
MDL Number:
MFCD12026483
IUPAC Name:
2-[4-bromo-3-(trifluoromethyl)phenyl]acetonitrile
InChI:
InChI=1S/C9H5BrF3N/c10-8-2-1-6(3-4-14)5-7(8)9(11,12)13/h1-2,5H,3H2
InChI Key:
RGGFAFIBVXMQSY-UHFFFAOYSA-N
Properties
Complexity:
242  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.956g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
264.045g/mol
Monoisotopic Mass:
262.956g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties