methyl 1-(4,6-dimethylpyrimidin-2-yl)triazole-4-carboxylate


Chemical Name: methyl 1-(4,6-dimethylpyrimidin-2-yl)triazole-4-carboxylate
CAS Number: 23947-13-9
Product Number: AG00CCHT(AGN-PC-0KKPQB)
Synonyms:
MDL No:
Molecular Formula: C10H11N5O2
Molecular Weight: 233.2266

Identification/Properties


Computed Properties
Molecular Weight:
233.231g/mol
XLogP3:
0.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
3
Exact Mass:
233.091g/mol
Monoisotopic Mass:
233.091g/mol
Topological Polar Surface Area:
82.8A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
278
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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