Home Halogens 4,5-Dichloro-2-nitrobenzotrifluoride

4,5-Dichloro-2-nitrobenzotrifluoride

CAS No.:
50594-31-5
Catalog Number:
AG003IFZ
Molecular Formula:
C7H2Cl2F3NO2
Molecular Weight:
259.9975
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$19
- +
25g
98%
In Stock USA
United States
$60
- +
100g
98%
In Stock USA
United States
$219
- +
500g
98%
In Stock USA
United States
$900
- +
Product Description
Catalog Number:
AG003IFZ
Chemical Name:
4,5-Dichloro-2-nitrobenzotrifluoride
CAS Number:
50594-31-5
Molecular Formula:
C7H2Cl2F3NO2
Molecular Weight:
259.9975
MDL Number:
MFCD00236666
IUPAC Name:
1,2-dichloro-4-nitro-5-(trifluoromethyl)benzene
InChI:
InChI=1S/C7H2Cl2F3NO2/c8-4-1-3(7(10,11)12)6(13(14)15)2-5(4)9/h1-2H
InChI Key:
MMUARSWOJRDXBV-UHFFFAOYSA-N
SMILES:
Clc1cc([N+](=O)[O-])c(cc1Cl)C(F)(F)F
Properties
Complexity:
256  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.941g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
259.993g/mol
Monoisotopic Mass:
258.941g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  
Properties