Home Halogens 3-Chloro-2-fluoro-5-nitrobenzotrifluoride

3-Chloro-2-fluoro-5-nitrobenzotrifluoride

CAS No.:
914225-55-1
Catalog Number:
AG00GRPE
Molecular Formula:
C7H2ClF4NO2
Molecular Weight:
243.5429
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$183
- +
5g
98%
In Stock USA
United States
$547
- +
25g
98%
In Stock USA
United States
$1639
- +
Product Description
Catalog Number:
AG00GRPE
Chemical Name:
3-Chloro-2-fluoro-5-nitrobenzotrifluoride
CAS Number:
914225-55-1
Molecular Formula:
C7H2ClF4NO2
Molecular Weight:
243.5429
MDL Number:
MFCD09033153
IUPAC Name:
1-chloro-2-fluoro-5-nitro-3-(trifluoromethyl)benzene
InChI:
InChI=1S/C7H2ClF4NO2/c8-5-2-3(13(14)15)1-4(6(5)9)7(10,11)12/h1-2H
InChI Key:
DXSHRLNTFMMNIQ-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(Cl)c(c(c1)C(F)(F)F)F
Properties
Complexity:
254  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.971g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
243.542g/mol
Monoisotopic Mass:
242.971g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties