Home Halogens 3-bromo-2-iodobenzonitrile

3-bromo-2-iodobenzonitrile

CAS No.:
450412-21-2
Catalog Number:
AG01ACW9
Molecular Formula:
C7H3BrIN
Molecular Weight:
307.9139
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Product Description
Catalog Number:
AG01ACW9
Chemical Name:
3-bromo-2-iodobenzonitrile
CAS Number:
450412-21-2
Molecular Formula:
C7H3BrIN
Molecular Weight:
307.9139
MDL Number:
MFCD18391644
IUPAC Name:
3-bromo-2-iodobenzonitrile
InChI:
InChI=1S/C7H3BrIN/c8-6-3-1-2-5(4-10)7(6)9/h1-3H
InChI Key:
CURBUBRIORQIAT-UHFFFAOYSA-N
SMILES:
N#Cc1cccc(c1I)Br
Properties
Complexity:
162  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.849g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
307.916g/mol
Monoisotopic Mass:
306.849g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties