Home Aminos tert-Butyl 4-amino-2-(trifluoromethyl)benzoate

tert-Butyl 4-amino-2-(trifluoromethyl)benzoate

CAS No.:
1311200-05-1
Catalog Number:
AG009YAW
Molecular Formula:
C12H14F3NO2
Molecular Weight:
261.2403
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
1 week
United States
$135
- +
Product Description
Catalog Number:
AG009YAW
Chemical Name:
tert-Butyl 4-amino-2-(trifluoromethyl)benzoate
CAS Number:
1311200-05-1
Molecular Formula:
C12H14F3NO2
Molecular Weight:
261.2403
MDL Number:
MFCD08703395
IUPAC Name:
tert-butyl 4-amino-2-(trifluoromethyl)benzoate
InChI:
InChI=1S/C12H14F3NO2/c1-11(2,3)18-10(17)8-5-4-7(16)6-9(8)12(13,14)15/h4-6H,16H2,1-3H3
InChI Key:
CLJQXSMSVHCCST-UHFFFAOYSA-N
SMILES:
Nc1ccc(c(c1)C(F)(F)F)C(=O)OC(C)(C)C
Properties
Complexity:
309  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.098g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
261.244g/mol
Monoisotopic Mass:
261.098g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties