4-Pyridinecarboxylic acid, 5-bromo-2-(trifluoromethyl)-


Chemical Name: 4-Pyridinecarboxylic acid, 5-bromo-2-(trifluoromethyl)-
CAS Number: 749875-16-9
Product Number: AG003MG7(AGN-PC-05CAGZ)
Synonyms:
MDL No: MFCD10687236
Molecular Formula: C7H3BrF3NO2
Molecular Weight: 270.0034

Identification/Properties


Properties
MP:
235-238℃
BP:
371.6°C at 760 mmHg
Storage:
Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
270.005g/mol
XLogP3:
2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
1
Exact Mass:
268.93g/mol
Monoisotopic Mass:
268.93g/mol
Topological Polar Surface Area:
50.2A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
234
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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