716361-89-6
Product Name:
1H-1,2,3-Triazole-4-carboxylicacid,5-ethyl-1-phenyl-(9CI)
Formula:
C11H11N3O2
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COMPUTED DESCRIPTORS
Molecular Weight | 217.22 g/mol |
---|---|
XLogP3 | 2 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 3 |
Exact Mass | 217.085126602 g/mol |
Monoisotopic Mass | 217.085126602 g/mol |
Topological Polar Surface Area | 68 Ų |
Heavy Atom Count | 16 |
Formal Charge | 0 |
Complexity | 254 |
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 |