3-Pyridinecarboxylic acid, 6-chloro-5-nitro-, methyl ester


Chemical Name: 3-Pyridinecarboxylic acid, 6-chloro-5-nitro-, methyl ester
CAS Number: 59237-53-5
Product Number: AG00359C(AGN-PC-0JMHWE)
Synonyms:
MDL No:
Molecular Formula: C7H5ClN2O4
Molecular Weight: 216.5786

Identification/Properties


Properties
MP:
76℃
BP:
317.8°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
216.577g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
215.994g/mol
Monoisotopic Mass:
215.994g/mol
Topological Polar Surface Area:
85A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
242
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-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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