Morphine, diacetyl-, hydrochloride
TL;DR: Morphine, diacetyl-, hydrochloride (CAS 1502-95-0) is a chemical compound with molecular formula C21H24ClNO5 and molecular weight 405.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(9-acetyloxy-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-yl) acetate;hydrochloride
Also Known As: Heroin hydrochloride, Morphine, diacetyl-, hydrochloride, [(4R,4aR,7S,7aR,12bS)-9-acetyloxy-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-yl] acetate;hydrochloride
| Molecular Formula | C21H24ClNO5 |
|---|---|
| Molecular Weight | 405.13 g/mol |
| LogP | 2.4104 |
| Topological Polar Surface Area | 65.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 405.1343 |
| Heavy Atoms | 28 |
| Complexity | 692.0 |
Chemical Identifiers
| CAS Number | 1502-95-0 |
|---|---|
| SMILES | CC(=O)OC1C=CC2C3CC4=C5C2(C1OC5=C(C=C4)OC(=O)C)CCN3C.Cl |
| InChIKey | FZJYQGFGNHGSFX-UHFFFAOYSA-N |
Product Overview
Morphine, diacetyl-, hydrochloride (CAS 1502-95-0), with molecular formula C21H24ClNO5 and molecular weight 405.13 g/mol. IUPAC: (9-acetyloxy-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-yl) acetate;hydrochloride.
Chemical Property Profile of Morphine, diacetyl-, hydrochloride
Property Insights of Morphine, diacetyl-, hydrochloride
The XLogP value of 2.4104 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Morphine, diacetyl-, hydrochloride. The TPSA of 65.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Morphine, diacetyl-, hydrochloride. Following Lipinski's Rule of Five, Morphine, diacetyl-, hydrochloride has 1 hydrogen bond donor(s) and 6 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 Morphine, diacetyl-, hydrochloride?
The CAS number of Morphine, diacetyl-, hydrochloride is 1502-95-0.
What is the molecular formula of Morphine, diacetyl-, hydrochloride?
The molecular formula of Morphine, diacetyl-, hydrochloride is C21H24ClNO5.
What is the molecular weight of Morphine, diacetyl-, hydrochloride?
The molecular weight of Morphine, diacetyl-, hydrochloride is 405.13 g/mol.
Where can I buy Morphine, diacetyl-, hydrochloride?
You can request a quote for Morphine, diacetyl-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Morphine, diacetyl-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Morphine, diacetyl-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.