| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 23rd, 2009 | 17 | Yes |
Popular Name: 3-[2-(tert-Butyl)-4-methylphenoxy]pyrrolidinehydrochloride 3-[2-(tert-Butyl)-4-methylphenox…
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CAS Numbers: 1219979-42-6 , N/A
3-(2-(tert-Butyl)-4-methylphenoxy)pyrrolidine hydrochloride
3-[2-(tert-Butyl)-4-methylphenoxy]pyrrolidine hydrochloride
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 3.98 | 7.55 | -41.08 | 2 | 2 | 1 | 26 | 234.363 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.98 | 6.09 | -2.53 | 1 | 2 | 0 | 21 | 233.355 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
