alpha-Chlorocodide
(4R,4aR,7R,7aR,12bS)-7-chloro-9-methoxy-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline
Also Known As: alpha-Chlorocodide|Codide, alpha-chloro-|6b-chloro-6-deoxycodeine|6.BETA.-CHLORO-6-DEOXYCODEINE|CODEINE, 6.BETA.-CHLORO-6-DEOXY-|4-27-00-02072 (Beilstein Handbook Reference)|J2.943.346A|Morphinan, 6-alpha-chloro-7,8-didehydro-4,5-alpha-epoxy-3-methoxy-17-methyl-|Morphinan, 6-chloro-7,8-didehydro-4,5-epoxy-3-methoxy-17-methyl-, (5alpha,6beta)-|6beta-Chloro-3-methoxy-17-methyl-5alpha-7,8-didehydro-4,5-epoxymorphinan|6beta-Chloro-7,8-didehydro-4,5alpha-epoxy-3-methoxy-17-methylmorphinan|MORPHINAN, 6.BETA.-CHLORO-7,8-DIDEHYDRO-4,5.ALPHA.-EPOXY-3-METHOXY-17-METHYL-|(1S,5R,13R,14R,17R)-14-chloro-10-methoxy-4-methyl-12-oxa-4-azapentacyclo[9.6.1.0{1,13}.0{5,17}.0{7,18}]octadeca-7,9,11(18),15-tetraene|(1S,5R,13R,14R,17R)-14-chloro-10-methoxy-4-methyl-12-oxa-4-azapentacyclo[9.6.1.01,13.05,17.07,18]octadeca-7,9,11(18),15-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 | 467-08-3 |
|---|---|
| SMILES | CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3[C@@H](C=C4)Cl |
Product Overview
alpha-Chlorocodide (CAS 467-08-3), with molecular formula C18H20ClNO2 and molecular weight 317.11826 g/mol. IUPAC: (4R,4aR,7R,7aR,12bS)-7-chloro-9-methoxy-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline.