In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 5th, 2008 | 22 | Yes |
Popular Name: (3S,4R)-1-BOC-3-HYDROXYMETHYL-4-(4-FLUOROPHENYL)-PIPERIDINE (3S,4R)-1-BOC-3-HYDROXYMETHYL-4-…
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CAS Numbers: 200572-33-4 , 936497-90-4
(3S,4R)-(-)-N-tert-butyloxycarbonyl-4-(4-fluorophenyl)-3-hydroxymethylpiperidine
(3S,4R)-1-Boc-3-hydroxymethyl-4-(4-fluorophenyl)-piperidine
(3S,4R)-1-£¿Boc-3-hydroxymethyl-£¿4-(4-fluorophenyl)-piperidine
(3S,4R)-tert-Butyl 4-(4-fluorophenyl)-3-(hydroxymethyl)piperidine-1-carboxylate
1-BOC-3-HYDROXYMETHYL-4- -PIPERIDINE
1-Boc-3-hydroxymethyl-4-(4-fluorophenyl)-piperidine
4-(4-Fluoro-phenyl)-3-hydroxymethyl-piperidine-1-carboxylic acid tert-butyl ester
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) | 3.48 | 6.18 | -10.35 | 1 | 4 | 0 | 50 | 309.381 | 4 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Purity | 95% | Fluorochem |
PUBCHEM_PATENT_ID | EP0812827A1; US5948914 | IBM Patent Data |