1H-1,2,3-Triazole-4-carboxylic acid, 1-(2-methoxyphenyl)-5-methyl-


Chemical Name: 1H-1,2,3-Triazole-4-carboxylic acid, 1-(2-methoxyphenyl)-5-methyl-
CAS Number: 210159-13-0
Product Number: AG00BDMH(AGN-PC-0LUC3C)
Synonyms:
MDL No:
Molecular Formula: C11H11N3O3
Molecular Weight: 233.2233

Identification/Properties


Computed Properties
Molecular Weight:
233.227g/mol
XLogP3:
1.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
3
Exact Mass:
233.08g/mol
Monoisotopic Mass:
233.08g/mol
Topological Polar Surface Area:
77.2A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
287
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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