55699-10-0
Product Name:
4-TERT-BUTYL-3-HYDROXY-2,6-DIMETHYLPHENYLACETONITRILE
Formula:
C14H19NO
Synonyms:
2-[4-(1,1-Dimethylethyl)-3-hydroxy-2,6-dimethylphenyl]acetonitrile;Oxymetazoline impurity E (PhEur)
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COMPUTED DESCRIPTORS
| Molecular Weight | 217.31 g/mol |
|---|---|
| XLogP3 | 3.6 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 2 |
| Exact Mass | 217.146664230 g/mol |
| Monoisotopic Mass | 217.146664230 g/mol |
| Topological Polar Surface Area | 44 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 283 |
| 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 |