3-alpha-Tropanyl-(1-hydroxycyclopentyl)phenylacetate hydrochloride
TL;DR: 3-alpha-Tropanyl-(1-hydroxycyclopentyl)phenylacetate hydrochloride (CAS 101931-99-1) is a chemical compound with molecular formula C21H30ClNO3 and molecular weight 379.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-(1-hydroxycyclopentyl)-2-phenylacetate;hydrochloride
Also Known As: 3-alpha-Tropanyl-(1-hydroxycyclopentyl)phenylacetate hydrochloride, Cyclopentaneacetic acid, 1-hydroxy-alpha-phenyl-, 3-alpha-tropanyl ester, hydrochloride, (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-(1-hydroxycyclopentyl)-2-phenylacetate hydrochloride, 8-Methyl-8-azabicyclo[3.2.1]octan-3-yl (1-hydroxycyclopentyl)(phenyl)acetate--hydrogen chloride (1/1), RefChem:335896
| Molecular Formula | C21H30ClNO3 |
|---|---|
| Molecular Weight | 379.19 g/mol |
| LogP | 3.6655 |
| Topological Polar Surface Area | 49.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 379.1914 |
| Heavy Atoms | 26 |
| Complexity | 602.942 |
Chemical Identifiers
| CAS Number | 101931-99-1 |
|---|---|
| SMILES | CN1C2CCC1CC(C2)OC(=O)C(C3=CC=CC=C3)C4(CCCC4)O.Cl |
Product Overview
3-alpha-Tropanyl-(1-hydroxycyclopentyl)phenylacetate hydrochloride (CAS 101931-99-1), with molecular formula C21H30ClNO3 and molecular weight 379.19 g/mol. IUPAC: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-(1-hydroxycyclopentyl)-2-phenylacetate;hydrochloride.
Chemical Property Profile of 3-alpha-Tropanyl-(1-hydroxycyclopentyl)phenylacetate hydrochloride
Property Insights of 3-alpha-Tropanyl-(1-hydroxycyclopentyl)phenylacetate hydrochloride
The XLogP value of 3.6655 indicates that 3-alpha-Tropanyl-(1-hydroxycyclopentyl)phenylacetate hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.77 Ų, 3-alpha-Tropanyl-(1-hydroxycyclopentyl)phenylacetate hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-alpha-Tropanyl-(1-hydroxycyclopentyl)phenylacetate hydrochloride has 1 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 3-alpha-Tropanyl-(1-hydroxycyclopentyl)phenylacetate hydrochloride?
The CAS number of 3-alpha-Tropanyl-(1-hydroxycyclopentyl)phenylacetate hydrochloride is 101931-99-1.
What is the molecular formula of 3-alpha-Tropanyl-(1-hydroxycyclopentyl)phenylacetate hydrochloride?
The molecular formula of 3-alpha-Tropanyl-(1-hydroxycyclopentyl)phenylacetate hydrochloride is C21H30ClNO3.
What is the molecular weight of 3-alpha-Tropanyl-(1-hydroxycyclopentyl)phenylacetate hydrochloride?
The molecular weight of 3-alpha-Tropanyl-(1-hydroxycyclopentyl)phenylacetate hydrochloride is 379.19 g/mol.
Where can I buy 3-alpha-Tropanyl-(1-hydroxycyclopentyl)phenylacetate hydrochloride?
You can request a quote for 3-alpha-Tropanyl-(1-hydroxycyclopentyl)phenylacetate hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-alpha-Tropanyl-(1-hydroxycyclopentyl)phenylacetate hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 3-alpha-Tropanyl-(1-hydroxycyclopentyl)phenylacetate hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.