In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 18 | Yes |
Popular Name: 3-[2-chloro-4-(tert-pentyl)phenoxy]pyrrolidinehydrochloride 3-[2-chloro-4-(tert-pentyl)pheno…
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CAS Numbers: 1220032-89-2 , N/A
3-(2-Chloro-4-(tert-pentyl)phenoxy)pyrrolidine hydrochloride
3-[2-Chloro-4-(tert-pentyl)phenoxy]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) | 4.53 | 7.54 | -41 | 2 | 2 | 1 | 26 | 268.808 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.53 | 6.08 | -3.37 | 1 | 2 | 0 | 21 | 267.8 | 4 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Warnings | IRRITANT | Matrix Scientific |