6-Chloro-17-methyl-4,5-epoxymorphinan-3-ol
TL;DR: 6-Chloro-17-methyl-4,5-epoxymorphinan-3-ol (CAS 59971-06-1) is a chemical compound with molecular formula C17H20ClNO2 and molecular weight 305.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4R,4aR,7S,7aR,12bS)-7-chloro-3-methyl-2,4,4a,5,6,7,7a,13-octahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-9-ol
Also Known As: Chlorodihydromorphide, Morphide, chlorodihydro-, 2-27-00-00077 (Beilstein Handbook Reference), 6-Chloro-17-methyl-4,5-epoxymorphinan-3-ol, Morphinan-3-ol, 6-alpha-chloro-4,5-alpha-epoxy-17-methyl-
| Molecular Formula | C17H20ClNO2 |
|---|---|
| Molecular Weight | 305.12 g/mol |
| LogP | 2.6686 |
| Topological Polar Surface Area | 32.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 305.11826 |
| Heavy Atoms | 21 |
| Complexity | 633.4613 |
Chemical Identifiers
| CAS Number | 59971-06-1 |
|---|---|
| SMILES | CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)O)O[C@H]3[C@H](CC4)Cl |
Product Overview
6-Chloro-17-methyl-4,5-epoxymorphinan-3-ol (CAS 59971-06-1), with molecular formula C17H20ClNO2 and molecular weight 305.12 g/mol. IUPAC: (4R,4aR,7S,7aR,12bS)-7-chloro-3-methyl-2,4,4a,5,6,7,7a,13-octahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-9-ol.
Chemical Property Profile of 6-Chloro-17-methyl-4,5-epoxymorphinan-3-ol
Property Insights of 6-Chloro-17-methyl-4,5-epoxymorphinan-3-ol
The XLogP value of 2.6686 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Chloro-17-methyl-4,5-epoxymorphinan-3-ol. With a topological polar surface area (TPSA) of 32.7 Ų, 6-Chloro-17-methyl-4,5-epoxymorphinan-3-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Chloro-17-methyl-4,5-epoxymorphinan-3-ol has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-Chloro-17-methyl-4,5-epoxymorphinan-3-ol?
The CAS number of 6-Chloro-17-methyl-4,5-epoxymorphinan-3-ol is 59971-06-1.
What is the molecular formula of 6-Chloro-17-methyl-4,5-epoxymorphinan-3-ol?
The molecular formula of 6-Chloro-17-methyl-4,5-epoxymorphinan-3-ol is C17H20ClNO2.
What is the molecular weight of 6-Chloro-17-methyl-4,5-epoxymorphinan-3-ol?
The molecular weight of 6-Chloro-17-methyl-4,5-epoxymorphinan-3-ol is 305.12 g/mol.
Where can I buy 6-Chloro-17-methyl-4,5-epoxymorphinan-3-ol?
You can request a quote for 6-Chloro-17-methyl-4,5-epoxymorphinan-3-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Chloro-17-methyl-4,5-epoxymorphinan-3-ol?
Yes, KEHONG BIO provides custom synthesis services for 6-Chloro-17-methyl-4,5-epoxymorphinan-3-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.