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

3-amino-6-bromo-2-methylbenzonitrile

CAS No.:
1459253-66-7
Catalog Number:
AG01C1FF
Molecular Formula:
C8H7BrN2
Molecular Weight:
211.0586
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Product Description
Catalog Number:
AG01C1FF
Chemical Name:
3-amino-6-bromo-2-methylbenzonitrile
CAS Number:
1459253-66-7
Molecular Formula:
C8H7BrN2
Molecular Weight:
211.0586
MDL Number:
MFCD29058663
IUPAC Name:
3-amino-6-bromo-2-methylbenzonitrile
InChI:
InChI=1S/C8H7BrN2/c1-5-6(4-10)7(9)2-3-8(5)11/h2-3H,11H2,1H3
InChI Key:
MOMBMFUFKAKPAF-UHFFFAOYSA-N
SMILES:
N#Cc1c(Br)ccc(c1C)N
Properties
Complexity:
184  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.979g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
211.062g/mol
Monoisotopic Mass:
209.979g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties