In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2008 | 19 | Yes |
Popular Name: 6-hydroxy-1,4-dimethyl-5-(morpholinomethyl)-2-oxo-1,2-dihydro-3-pyridinecarbonitrile 6-hydroxy-1,4-dimethyl-5-(morpho…
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CAS Numbers: 85843-03-4 , [85843-03-4]
1-Tosylpiperidine-4-carboxylic acid
6-Hydroxy-1,4-dimethyl-5-(morpholinomethyl)-2-oxo-1,2-dihydropyridine-3-carbonitrile
HYDROXYDIMETHYLMORPHOLINOMETHYLOXODIHYDROPYRIDINECARBONITRIL
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) | 0.21 | 0.85 | -33.66 | 0 | 6 | -1 | 81 | 262.289 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
melting_point | 2.090000000000000e+002 - 2.120000000000000e+002 | KeyOrganics |
melting_point | 209 - 212 | KeyOrganics |
MP | 209-212° | Matrix Scientific |
Purity | >95% | Matrix Scientific |
Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.