In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2009 | 14 | Yes |
Popular Name: 3-(4-Chloro-3-methylphenoxy)pyrrolidine hydrochloride 3-(4-Chloro-3-methylphenoxy)pyrr…
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CAS Numbers: 1219961-08-6 , N/A , [1219961-08-6]
3-(4-Chloro-3-methylphenoxy)pyrrolidinehydrochloride
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) | 2.95 | 5.3 | -42.15 | 2 | 2 | 1 | 26 | 212.7 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.95 | 3.84 | -2.85 | 1 | 2 | 0 | 21 | 211.692 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Warnings | IRRITANT | Matrix Scientific |