| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 2nd, 2005 | 12 | Yes |
Popular Name: Hordenine Hordenine
Find On: PubMed — Wikipedia — Google
CAS Numbers: , 3595-05-9 , 3595-05-9 , 62493-39-4 , 539-15-1 , 539-15-1 , 6027-23-2 , 622-64-0 , 62493-39-4 , [539-15-1] , [62493-39-4]
2-(4-Hydroxyphenyl) N,N-dimethyl-ethylamine hydrochloride
2-(4-Hydroxyphenyl) n,n-dimethylethylaminehydrochloride
2-(4-Hydroxyphenyl)-N,N-dimethylethylamine
2-(4-Hydroxyphenyl)-N,N-dimethylethylamine hydrochloride
2-(4-Hydroxyphenyl)-N,N-dimethylethylaminehydrochloride
4-(2-(Dimethylamino)ethyl)phenol
4-(2-(Dimethylamino)ethyl)phenol hydrochloride
4-(2-(Dimethylamino)ethyl)phenol sulfate
4-(2-(Dimethylamino)ethyl)phenolhydrochloride
4-[2-(Dimethylamino)ethyl]phenol; 539-15-1; C06199; Hordenine
| 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) | 1.67 | 4.38 | -38.98 | 2 | 2 | 1 | 25 | 166.244 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.67 | 1.91 | -3.67 | 1 | 2 | 0 | 23 | 165.236 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.04 | 5.92 | -18.76 | 5 | 10 | 0 | 153 | 504.501 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 178-180° | Fluorochem |
| MP | 211 | TCI |
| Purity | 95% | Fluorochem |
| Purity | 97% | Fluorochem |
| Target | Antifection | Selleck Chemicals |
| Patent Database Links | EP1568770; US2007190187 | ChEBI |
| Target | Others | Selleck Chemicals |
