Dispiro[11H-benzo[5,6]cyclohepta[1,2-b]pyridine-11,2'-oxirane-3',4''-piperidine]-1''-carboxylic acid, 8-chloro-5,6-dihydro-, ethyl ester, 1-oxide
Bezeichnung:Dispiro[11H-benzo[5,6]cyclohepta[1,2-b]pyridine-11,2'-oxirane-3',4''-piperidine]-1''-carboxylic acid, 8-chloro-5,6-dihydro-, ethyl ester, 1-oxide
CAS-Nr1432057-93-6
Englisch Name:Dispiro[11H-benzo[5,6]cyclohepta[1,2-b]pyridine-11,2'-oxirane-3',4''-piperidine]-1''-carboxylic acid, 8-chloro-5,6-dihydro-, ethyl ester, 1-oxide
CBNumberCB58939154
SummenformelC22H23ClN2O4
Molgewicht414.88
MOL-Datei1432057-93-6.mol
Dispiro[11H-benzo[5,6]cyclohepta[1,2-b]pyridine-11,2'-oxirane-3',4''-piperidine]-1''-carboxylic acid, 8-chloro-5,6-dihydro-, ethyl ester, 1-oxide physikalisch-chemischer Eigenschaften
Siedepunkt | 614.6±55.0 °C(Predicted) |
Dichte | 1.41±0.1 g/cm3(Predicted) |
pka | 0.74±0.20(Predicted) |
InChI | InChI=1S/C22H23ClN2O4/c1-2-28-20(26)24-12-9-21(10-13-24)22(29-21)18-8-7-17(23)14-16(18)6-5-15-4-3-11-25(27)19(15)22/h3-4,7-8,11,14H,2,5-6,9-10,12-13H2,1H3 |
InChIKey | ZPCHCJCBRZXZHY-UHFFFAOYSA-N |
SMILES | C12C3(C4(CCN(C(OCC)=O)CC4)O3)C3=CC=C(Cl)C=C3CCC=1C=CC=[N+]2[O-] |