3-Pyridinecarboxylic acid, 5-bromo-6-chloro-


Chemical Name: 3-Pyridinecarboxylic acid, 5-bromo-6-chloro-
CAS Number: 29241-62-1
Product Number: AG002XTA(AGN-PC-0JP86N)
Synonyms:
MDL No: MFCD01927098
Molecular Formula: C6H3BrClNO2
Molecular Weight: 236.4505

Identification/Properties


Properties
MP:
166-168 °C
BP:
370°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
236.449g/mol
XLogP3:
2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
234.904g/mol
Monoisotopic Mass:
234.904g/mol
Topological Polar Surface Area:
50.2A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
167
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:
H302-H315-H319-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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