89497-63-2
Product Name:
1H-1,2,4-Triazole-1-ethanol, β-(4-chlorophenoxy)-α-(1,1-dimethylethyl)-, (αS,βR)-
Formula:
C14H18ClN3O2
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 295.76 g/mol |
|---|---|
| XLogP3 | 3.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 5 |
| Exact Mass | 295.1087545 g/mol |
| Monoisotopic Mass | 295.1087545 g/mol |
| Topological Polar Surface Area | 60.2 Ų |
| Heavy Atom Count | 20 |
| Formal Charge | 0 |
| Complexity | 303 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 2 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |