Benzoic acid, 2,4-bis(trifluoromethyl)-


Chemical Name: Benzoic acid, 2,4-bis(trifluoromethyl)-
CAS Number: 32890-87-2
Product Number: AG003FOV(AGN-PC-0JMS7A)
Synonyms:
MDL No:
Molecular Formula: C9H4F6O2
Molecular Weight: 258.1173

Identification/Properties


Properties
MP:
109-111 °C
BP:
219°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
258.119g/mol
XLogP3:
3.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
8
Rotatable Bond Count:
1
Exact Mass:
258.012g/mol
Monoisotopic Mass:
258.012g/mol
Topological Polar Surface Area:
37.3A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
295
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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