Home Halogens 4-(Isopropylamino)-3-nitrobenzotrifluoride

4-(Isopropylamino)-3-nitrobenzotrifluoride

CAS No.:
175277-90-4
Catalog Number:
AG00ACT1
Molecular Formula:
C10H11F3N2O2
Molecular Weight:
248.2017
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$63
- +
5g
98%
In Stock USA
United States
$150
- +
25g
98%
In Stock USA
United States
$450
- +
Product Description
Catalog Number:
AG00ACT1
Chemical Name:
4-(Isopropylamino)-3-nitrobenzotrifluoride
CAS Number:
175277-90-4
Molecular Formula:
C10H11F3N2O2
Molecular Weight:
248.2017
MDL Number:
MFCD00085098
IUPAC Name:
2-nitro-N-propan-2-yl-4-(trifluoromethyl)aniline
InChI:
InChI=1S/C10H11F3N2O2/c1-6(2)14-8-4-3-7(10(11,12)13)5-9(8)15(16)17/h3-6,14H,1-2H3
InChI Key:
KUROZHKSHLAXMC-UHFFFAOYSA-N
SMILES:
CC(Nc1ccc(cc1[N+](=O)[O-])C(F)(F)F)C
Properties
Complexity:
276  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.077g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
248.205g/mol
Monoisotopic Mass:
248.077g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties