Ethanone, 1-(4-(acetyloxy)-1-methyl-4-piperidinyl)-, hydrochloride
TL;DR: Ethanone, 1-(4-(acetyloxy)-1-methyl-4-piperidinyl)-, hydrochloride (CAS 98694-57-6) is a chemical compound with molecular formula C10H18ClNO3 and molecular weight 235.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-acetyl-1-methylpiperidin-4-yl) acetate;hydrochloride
Also Known As: 1-Methyl-4-acetyl-4-acetoxypiperidine hydrochloride, Ethanone, 1-(4-(acetyloxy)-1-methyl-4-piperidinyl)-, hydrochloride, 1-(4-(Acetyloxy)-1-methyl-4-piperidinyl)ethanone hydrochloride, (4-acetyl-1-methyl-4-piperidyl) acetate hydrochloride, (4-acetyl-1-methylpiperidin-4-yl) acetate hydrochloride
| Molecular Formula | C10H18ClNO3 |
|---|---|
| Molecular Weight | 235.10 g/mol |
| LogP | 1.0247 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 235.09752 |
| Heavy Atoms | 15 |
| Complexity | 247.05206 |
Chemical Identifiers
| CAS Number | 98694-57-6 |
|---|---|
| SMILES | CC(=O)C1(CCN(CC1)C)OC(=O)C.Cl |
Product Overview
Ethanone, 1-(4-(acetyloxy)-1-methyl-4-piperidinyl)-, hydrochloride (CAS 98694-57-6), with molecular formula C10H18ClNO3 and molecular weight 235.10 g/mol. IUPAC: (4-acetyl-1-methylpiperidin-4-yl) acetate;hydrochloride.
Chemical Property Profile of Ethanone, 1-(4-(acetyloxy)-1-methyl-4-piperidinyl)-, hydrochloride
Property Insights of Ethanone, 1-(4-(acetyloxy)-1-methyl-4-piperidinyl)-, hydrochloride
The XLogP value of 1.0247 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanone, 1-(4-(acetyloxy)-1-methyl-4-piperidinyl)-, hydrochloride. With a topological polar surface area (TPSA) of 46.61 Ų, Ethanone, 1-(4-(acetyloxy)-1-methyl-4-piperidinyl)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanone, 1-(4-(acetyloxy)-1-methyl-4-piperidinyl)-, hydrochloride has 0 hydrogen bond donor(s) and 4 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-(4-(acetyloxy)-1-methyl-4-piperidinyl)-, hydrochloride?
The CAS number of Ethanone, 1-(4-(acetyloxy)-1-methyl-4-piperidinyl)-, hydrochloride is 98694-57-6.
What is the molecular formula of Ethanone, 1-(4-(acetyloxy)-1-methyl-4-piperidinyl)-, hydrochloride?
The molecular formula of Ethanone, 1-(4-(acetyloxy)-1-methyl-4-piperidinyl)-, hydrochloride is C10H18ClNO3.
What is the molecular weight of Ethanone, 1-(4-(acetyloxy)-1-methyl-4-piperidinyl)-, hydrochloride?
The molecular weight of Ethanone, 1-(4-(acetyloxy)-1-methyl-4-piperidinyl)-, hydrochloride is 235.10 g/mol.
Where can I buy Ethanone, 1-(4-(acetyloxy)-1-methyl-4-piperidinyl)-, hydrochloride?
You can request a quote for Ethanone, 1-(4-(acetyloxy)-1-methyl-4-piperidinyl)-, 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-(4-(acetyloxy)-1-methyl-4-piperidinyl)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Ethanone, 1-(4-(acetyloxy)-1-methyl-4-piperidinyl)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.