Home Other Building Blocks 2,3,5-Trifluoroaniline

2,3,5-Trifluoroaniline

CAS No.:
363-80-4
Catalog Number:
AG003FFB
Molecular Formula:
C6H4F3N
Molecular Weight:
147.0979
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$57
- +
5g
96%
In Stock USA
United States
$150
- +
Product Description
Catalog Number:
AG003FFB
Chemical Name:
2,3,5-Trifluoroaniline
CAS Number:
363-80-4
Molecular Formula:
C6H4F3N
Molecular Weight:
147.0979
MDL Number:
MFCD00083549
IUPAC Name:
2,3,5-trifluoroaniline
InChI:
InChI=1S/C6H4F3N/c7-3-1-4(8)6(9)5(10)2-3/h1-2H,10H2
InChI Key:
AMGDNQWQBWPRPR-UHFFFAOYSA-N
SMILES:
Fc1cc(N)c(c(c1)F)F
Properties
Complexity:
120  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
147.03g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
147.1g/mol
Monoisotopic Mass:
147.03g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Literature
Title Journal
Combined experimental and computational study of the thermochemistry of the fluoroaniline isomers. The journal of physical chemistry. B 20070301
Properties