1033463-40-9
Product Name:
5-methyl-1-(4-methylbenzyl)-1H-1,2,3-triazole-4-carboxylic acid
Formula:
C12H13N3O2
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COMPUTED DESCRIPTORS
Molecular Weight | 231.25 g/mol |
---|---|
XLogP3 | 1.9 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 3 |
Exact Mass | 231.100776666 g/mol |
Monoisotopic Mass | 231.100776666 g/mol |
Topological Polar Surface Area | 68 Ų |
Heavy Atom Count | 17 |
Formal Charge | 0 |
Complexity | 277 |
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 |