2,4-Dinitrophenylmorphine hydrochloride
TL;DR: 2,4-Dinitrophenylmorphine hydrochloride (CAS 63732-56-9) is a chemical compound with molecular formula C23H22ClN3O7 and molecular weight 487.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4R,4aR,7S,7aR,12bS)-9-(2,4-dinitrophenoxy)-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-ol;hydrochloride
Also Known As: 2,4-Dinitrophenylmorphine hydrochloride, 2,4-Dinitrophenyl ether of morphine hydrochloride, Morphinan-6-alpha-ol, 7,8-didehydro-3-alpha-(2',4'-dinitro)phenoxy-4,5-alpha-epoxy-17-methyl-, hydrochloride, (4R,4aR,7S,7aR,12bS)-9-(2,4-dinitrophenoxy)-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7-ol,hydrochloride, 3-(2,4-Dinitrophenoxy)-17-methyl-5alpha-7,8-didehydro-4,5-epoxymorphinan-6alpha-ol--hydrogen chloride (1/1)
| Molecular Formula | C23H22ClN3O7 |
|---|---|
| Molecular Weight | 487.11 g/mol |
| LogP | 3.523 |
| Topological Polar Surface Area | 128.21 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 487.11462 |
| Heavy Atoms | 34 |
| Complexity | 1251.3098 |
Chemical Identifiers
| CAS Number | 63732-56-9 |
|---|---|
| SMILES | CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC6=C(C=C(C=C6)[N+](=O)[O-])[N+](=O)[O-])O[C@H]3[C@H](C=C4)O.Cl |
Product Overview
2,4-Dinitrophenylmorphine hydrochloride (CAS 63732-56-9), with molecular formula C23H22ClN3O7 and molecular weight 487.11 g/mol. IUPAC: (4R,4aR,7S,7aR,12bS)-9-(2,4-dinitrophenoxy)-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-ol;hydrochloride.
Chemical Property Profile of 2,4-Dinitrophenylmorphine hydrochloride
Property Insights of 2,4-Dinitrophenylmorphine hydrochloride
The XLogP value of 3.523 indicates that 2,4-Dinitrophenylmorphine hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 128.21 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-Dinitrophenylmorphine hydrochloride. Following Lipinski's Rule of Five, 2,4-Dinitrophenylmorphine hydrochloride has 1 hydrogen bond donor(s) and 8 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 2,4-Dinitrophenylmorphine hydrochloride?
The CAS number of 2,4-Dinitrophenylmorphine hydrochloride is 63732-56-9.
What is the molecular formula of 2,4-Dinitrophenylmorphine hydrochloride?
The molecular formula of 2,4-Dinitrophenylmorphine hydrochloride is C23H22ClN3O7.
What is the molecular weight of 2,4-Dinitrophenylmorphine hydrochloride?
The molecular weight of 2,4-Dinitrophenylmorphine hydrochloride is 487.11 g/mol.
Where can I buy 2,4-Dinitrophenylmorphine hydrochloride?
You can request a quote for 2,4-Dinitrophenylmorphine hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Dinitrophenylmorphine hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Dinitrophenylmorphine hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.