beta-Chlorocodide
(4R,4aR,5S,7aS,12bS)-5-chloro-9-methoxy-3-methyl-2,4,4a,5,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline
Also Known As: beta-Chlorocodide|Codide, beta-chloro-|Pseudocodeine, 8-beta-chloro-8-deoxy-|Morphinan, 8-beta-chloro-6,7-didehydro-4,5-alpha-epoxy-3-methoxy-17-methyl-|8beta-Chloro-6,7-didehydro-4,5alpha-epoxy-3-methoxy-17-methylmorphinan|8-Chloro-3-methoxy-17-methyl-6,7-didehydro-4,5-epoxymorphinan|8beta-Chloro-3-methoxy-17-methyl-5alpha-6,7-didehydro-4,5-epoxymorphinan|(1S,5R,13S,16S,17R)-16-chloro-10-methoxy-4-methyl-12-oxa-4-azapentacyclo[9.6.1.01,13.05,17.07,18]octadeca-7,9,11(18),14-tetraene
| Molecular Formula | C18H20ClNO2 |
|---|---|
| Molecular Weight | 317.11826 g/mol |
| LogP | 2.7476 |
| Topological Polar Surface Area | 21.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 317.11826 |
| Monoisotopic Mass | 317.11826 |
| Heavy Atoms | 22 |
| Complexity | 687.9099 |
Chemical Identifiers
| CAS Number | 466-95-5 |
|---|---|
| SMILES | CN1CC[C@]23[C@@H]4C=C[C@@H]([C@H]2[C@H]1CC5=C3C(=C(C=C5)OC)O4)Cl |
Product Overview
beta-Chlorocodide (CAS 466-95-5), with molecular formula C18H20ClNO2 and molecular weight 317.11826 g/mol. IUPAC: (4R,4aR,5S,7aS,12bS)-5-chloro-9-methoxy-3-methyl-2,4,4a,5,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline.