Home Halogens 4-Bromo-2-chloro-5-fluorobenzonitrile

4-Bromo-2-chloro-5-fluorobenzonitrile

CAS No.:
1126779-33-6
Catalog Number:
AG00929H
Molecular Formula:
C7H2BrClFN
Molecular Weight:
234.4529
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$563
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Product Description
Catalog Number:
AG00929H
Chemical Name:
4-Bromo-2-chloro-5-fluorobenzonitrile
CAS Number:
1126779-33-6
Molecular Formula:
C7H2BrClFN
Molecular Weight:
234.4529
MDL Number:
MFCD11036199
IUPAC Name:
4-bromo-2-chloro-5-fluorobenzonitrile
InChI:
InChI=1S/C7H2BrClFN/c8-5-2-6(9)4(3-11)1-7(5)10/h1-2H
InChI Key:
QRVZOLCBNJYMJK-UHFFFAOYSA-N
SMILES:
N#Cc1cc(F)c(cc1Cl)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:
232.904g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
234.452g/mol
Monoisotopic Mass:
232.904g/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