2-fluoro-3-(trifluoromethoxy)aniline


Chemical Name: 2-fluoro-3-(trifluoromethoxy)aniline
CAS Number: 1159512-64-7
Product Number: AG000H6T(AGN-PC-050B65)
Synonyms:
MDL No:
Molecular Formula: C7H5F4NO
Molecular Weight: 195.1143

Identification/Properties


Computed Properties
Molecular Weight:
195.117g/mol
XLogP3:
2.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
1
Exact Mass:
195.031g/mol
Monoisotopic Mass:
195.031g/mol
Topological Polar Surface Area:
35.2A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
172
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H227-H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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