Home Other Building Blocks N-BOC-4-Fluoro-3-trifluoromethylaniline

N-BOC-4-Fluoro-3-trifluoromethylaniline

CAS No.:
1072945-57-3
Catalog Number:
AG007WOT
Molecular Formula:
C12H13F4NO2
Molecular Weight:
279.2307
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$38
- +
5g
98%
In Stock USA
United States
$100
- +
10g
98%
In Stock USA
United States
$188
- +
25g
98%
In Stock USA
United States
$300
- +
100g
98%
In Stock USA
United States
$850
- +
Product Description
Catalog Number:
AG007WOT
Chemical Name:
N-BOC-4-Fluoro-3-trifluoromethylaniline
CAS Number:
1072945-57-3
Molecular Formula:
C12H13F4NO2
Molecular Weight:
279.2307
MDL Number:
MFCD11504831
IUPAC Name:
tert-butyl N-[4-fluoro-3-(trifluoromethyl)phenyl]carbamate
InChI:
InChI=1S/C12H13F4NO2/c1-11(2,3)19-10(18)17-7-4-5-9(13)8(6-7)12(14,15)16/h4-6H,1-3H3,(H,17,18)
InChI Key:
MCADTPSZYQWCMT-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)Nc1ccc(c(c1)C(F)(F)F)F
Properties
Complexity:
325  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.088g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
279.235g/mol
Monoisotopic Mass:
279.088g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2  
Properties