Home Nitriles 3-Bromo-2-fluoro-5-iodobenzonitrile

3-Bromo-2-fluoro-5-iodobenzonitrile

CAS No.:
1160574-12-8
Catalog Number:
AG01FDQ8
Molecular Formula:
C7H2BrFIN
Molecular Weight:
325.9044
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Product Description
Catalog Number:
AG01FDQ8
Chemical Name:
3-Bromo-2-fluoro-5-iodobenzonitrile
CAS Number:
1160574-12-8
Molecular Formula:
C7H2BrFIN
Molecular Weight:
325.9044
MDL Number:
MFCD11846060
IUPAC Name:
3-bromo-2-fluoro-5-iodobenzonitrile
InChI:
InChI=1S/C7H2BrFIN/c8-6-2-5(10)1-4(3-11)7(6)9/h1-2H
InChI Key:
MNSJLMXWCZEFKV-UHFFFAOYSA-N
SMILES:
N#Cc1cc(I)cc(c1F)Br
Properties
Complexity:
190  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
324.84g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
325.907g/mol
Monoisotopic Mass:
324.84g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties