Benzoic acid, 4-amino-3-(trifluoromethyl)-


Chemical Name: Benzoic acid, 4-amino-3-(trifluoromethyl)-
CAS Number: 400-76-0
Product Number: AG00C590(AGN-PC-0KR8ZT)
Synonyms:
MDL No:
Molecular Formula: C8H6F3NO2
Molecular Weight: 205.1339

Identification/Properties


Properties
MP:
204-206 °C
BP:
319.1°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Stability:
Air Sensitive
Computed Properties
Molecular Weight:
205.136g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
1
Exact Mass:
205.035g/mol
Monoisotopic Mass:
205.035g/mol
Topological Polar Surface Area:
63.3A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
229
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:
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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