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

5-Bromo-4-chloro-2-nitrobenzonitrile

CAS No.:
1393442-14-2
Catalog Number:
AG00HVJQ
Molecular Formula:
C7H2BrClN2O2
Molecular Weight:
261.4600
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$188
- +
5g
96%
In Stock USA
United States
$700
- +
Product Description
Catalog Number:
AG00HVJQ
Chemical Name:
5-Bromo-4-chloro-2-nitrobenzonitrile
CAS Number:
1393442-14-2
Molecular Formula:
C7H2BrClN2O2
Molecular Weight:
261.4600
MDL Number:
MFCD22383658
IUPAC Name:
5-bromo-4-chloro-2-nitrobenzonitrile
InChI:
InChI=1S/C7H2BrClN2O2/c8-5-1-4(3-10)7(11(12)13)2-6(5)9/h1-2H
InChI Key:
ZUICMBUZYPVZSU-UHFFFAOYSA-N
SMILES:
N#Cc1cc(Br)c(cc1[N+](=O)[O-])Cl
Properties
Complexity:
259  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.899g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
261.459g/mol
Monoisotopic Mass:
259.899g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties