methyl 3-chloro-5-(trifluoromethyl)pyridine-2-carboxylate


Chemical Name: methyl 3-chloro-5-(trifluoromethyl)pyridine-2-carboxylate
CAS Number: 655235-65-7
Product Number: AG003RRQ(AGN-PC-0KL0FA)
Synonyms:
MDL No: MFCD01570523
Molecular Formula: C8H5ClF3NO2
Molecular Weight: 239.5790

Identification/Properties


Properties
BP:
260°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
239.578g/mol
XLogP3:
2.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
2
Exact Mass:
238.996g/mol
Monoisotopic Mass:
238.996g/mol
Topological Polar Surface Area:
39.2A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
247
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-H320-H335
Precautionary Statements:
P261-P280-P301+P312-P302+P352-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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