936940-52-2
Product Name:
ETHYL 2-(5-(1-AMINOETHYL)-4H-1,2,4-TRIAZOL-3-YL)ACETATE
Formula:
C8H14N4O2
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COMPUTED DESCRIPTORS
| Molecular Weight | 198.22 g/mol |
|---|---|
| XLogP3 | -0.5 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 5 |
| Exact Mass | 198.11167570 g/mol |
| Monoisotopic Mass | 198.11167570 g/mol |
| Topological Polar Surface Area | 93.9 Ų |
| Heavy Atom Count | 14 |
| Formal Charge | 0 |
| Complexity | 200 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |