Ethanone, 1-(3,4-bis(acetyloxy)phenyl)-2-(dimethylamino)-, hydrochloride
TL;DR: Ethanone, 1-(3,4-bis(acetyloxy)phenyl)-2-(dimethylamino)-, hydrochloride (CAS 71595-22-7) is a chemical compound with molecular formula C14H18ClNO5 and molecular weight 315.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-acetyloxy-4-[2-(dimethylamino)acetyl]phenyl] acetate;hydrochloride
Also Known As: Ethanone, 1-(3,4-bis(acetyloxy)phenyl)-2-(dimethylamino)-, hydrochloride, 1-(3,4-Bis(acetyloxy)phenyl)-2-(dimethylamino)ethanone hydrochloride, [2-acetyloxy-4-[2-(dimethylamino)acetyl]phenyl] acetate hydrochloride, 4-(N,N-Dimethylglycyl)-1,2-phenylene diacetate--hydrogen chloride (1/1), RefChem:341121
| Molecular Formula | C14H18ClNO5 |
|---|---|
| Molecular Weight | 315.09 g/mol |
| LogP | 1.7033 |
| Topological Polar Surface Area | 72.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 315.08734 |
| Heavy Atoms | 21 |
| Complexity | 542.16595 |
Chemical Identifiers
| CAS Number | 71595-22-7 |
|---|---|
| SMILES | CC(=O)OC1=C(C=C(C=C1)C(=O)CN(C)C)OC(=O)C.Cl |
Product Overview
Ethanone, 1-(3,4-bis(acetyloxy)phenyl)-2-(dimethylamino)-, hydrochloride (CAS 71595-22-7), with molecular formula C14H18ClNO5 and molecular weight 315.09 g/mol. IUPAC: [2-acetyloxy-4-[2-(dimethylamino)acetyl]phenyl] acetate;hydrochloride.
Chemical Property Profile of Ethanone, 1-(3,4-bis(acetyloxy)phenyl)-2-(dimethylamino)-, hydrochloride
Property Insights of Ethanone, 1-(3,4-bis(acetyloxy)phenyl)-2-(dimethylamino)-, hydrochloride
The XLogP value of 1.7033 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanone, 1-(3,4-bis(acetyloxy)phenyl)-2-(dimethylamino)-, hydrochloride. The TPSA of 72.91 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethanone, 1-(3,4-bis(acetyloxy)phenyl)-2-(dimethylamino)-, hydrochloride. Following Lipinski's Rule of Five, Ethanone, 1-(3,4-bis(acetyloxy)phenyl)-2-(dimethylamino)-, hydrochloride has 0 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 Ethanone, 1-(3,4-bis(acetyloxy)phenyl)-2-(dimethylamino)-, hydrochloride?
The CAS number of Ethanone, 1-(3,4-bis(acetyloxy)phenyl)-2-(dimethylamino)-, hydrochloride is 71595-22-7.
What is the molecular formula of Ethanone, 1-(3,4-bis(acetyloxy)phenyl)-2-(dimethylamino)-, hydrochloride?
The molecular formula of Ethanone, 1-(3,4-bis(acetyloxy)phenyl)-2-(dimethylamino)-, hydrochloride is C14H18ClNO5.
What is the molecular weight of Ethanone, 1-(3,4-bis(acetyloxy)phenyl)-2-(dimethylamino)-, hydrochloride?
The molecular weight of Ethanone, 1-(3,4-bis(acetyloxy)phenyl)-2-(dimethylamino)-, hydrochloride is 315.09 g/mol.
Where can I buy Ethanone, 1-(3,4-bis(acetyloxy)phenyl)-2-(dimethylamino)-, hydrochloride?
You can request a quote for Ethanone, 1-(3,4-bis(acetyloxy)phenyl)-2-(dimethylamino)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanone, 1-(3,4-bis(acetyloxy)phenyl)-2-(dimethylamino)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Ethanone, 1-(3,4-bis(acetyloxy)phenyl)-2-(dimethylamino)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.