Home Halogens 3-amino-6-bromo-2-fluorobenzonitrile

3-amino-6-bromo-2-fluorobenzonitrile

CAS No.:
1507928-98-4
Catalog Number:
AG01DVG4
Molecular Formula:
C7H4BrFN2
Molecular Weight:
215.0225
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Product Description
Catalog Number:
AG01DVG4
Chemical Name:
3-amino-6-bromo-2-fluorobenzonitrile
CAS Number:
1507928-98-4
Molecular Formula:
C7H4BrFN2
Molecular Weight:
215.0225
MDL Number:
MFCD31617435
IUPAC Name:
3-amino-6-bromo-2-fluorobenzonitrile
InChI:
InChI=1S/C7H4BrFN2/c8-5-1-2-6(11)7(9)4(5)3-10/h1-2H,11H2
InChI Key:
GOGBAGGPPPUULH-UHFFFAOYSA-N
SMILES:
N#Cc1c(Br)ccc(c1F)N
Properties
Complexity:
188  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.954g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
215.025g/mol
Monoisotopic Mass:
213.954g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties