methyl 2,5,6-trichloropyrimidine-4-carboxylate


Chemical Name: methyl 2,5,6-trichloropyrimidine-4-carboxylate
CAS Number: 89284-85-5
Product Number: AG0040ZO(AGN-PC-0JOKBV)
Synonyms:
MDL No:
Molecular Formula: C6H3Cl3N2O2
Molecular Weight: 241.4592

Identification/Properties


Properties
MP:
46-49°
BP:
342.7°C at 760 mmHg
Storage:
Inert atmosphere;-10 ℃;
Form:
Solid
Computed Properties
Molecular Weight:
241.452g/mol
XLogP3:
2.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
239.926g/mol
Monoisotopic Mass:
239.926g/mol
Topological Polar Surface Area:
52.1A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
204
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


NMR Spectrum


Other Analytical Data


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