In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2009 | 17 | No |
Popular Name: Benzyl 4-oxo-3,4-dihydropyridine-1(2H)-carboxylate Benzyl 4-oxo-3,4-dihydropyridine…
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CAS Numbers: 185847-84-1 , N/A , [185847-84-1]
4-Oxo-3,4-dihydro-2H-pyridine-1-carboxylic acid benzyl ester
Benzyl 3,4-dihydro-4-oxo-pyridine-1(2H)-carboxylate
benzyl 4-oxo-1,2,3,4-tetrahydropyridine-1-carboxylate
Benzyl 4-oxo-3,4-dihydropyridine-1(2H)-carboxylate hydrochloride
benzyl-4-oxo-3,4-dihydropyridine-1(2H)-carboxylate
Benzyl4-oxo-3,4-dihydropyridine-1(2H)-carboxylate
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) | 1.27 | 7.05 | -8.81 | 0 | 4 | 0 | 47 | 231.251 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 65-67° | Matrix Scientific |
Purity | >95% | Matrix Scientific |
Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.