3-Pyridinecarboxylic acid, 2,4-dichloro-6-methyl-, ethyl ester


Chemical Name: 3-Pyridinecarboxylic acid, 2,4-dichloro-6-methyl-, ethyl ester
CAS Number: 86129-63-7
Product Number: AG004TWV(AGN-PC-0JTNN2)
Synonyms:
MDL No:
Molecular Formula: C9H9Cl2NO2
Molecular Weight: 234.0793

Identification/Properties


Properties
MP:
53 °C
BP:
298.2°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
234.076g/mol
XLogP3:
3.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
233.001g/mol
Monoisotopic Mass:
233.001g/mol
Topological Polar Surface Area:
39.2A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
213
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:
Danger
UN#:
2924
Hazard Statements:
H226-H312-H314-H318
Precautionary Statements:
P210-P280-P301+P330+P331-P302+P352-P305+P351+P338-P310
Class:
3,8
Packing Group:

NMR Spectrum


Other Analytical Data


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