Tropine phenylglyoxylate hydrochloride
TL;DR: Tropine phenylglyoxylate hydrochloride (CAS 64790-46-1) is a chemical compound with molecular formula C16H20ClNO3 and molecular weight 309.11 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-oxo-2-phenylacetate;hydrochloride
Also Known As: Tropine phenylglyoxylate HCl, Tropine phenylglyoxylate hydrochloride, 1-alpha-H,5-alpha-H-Tropan-3-alpha-ol, phenylglyoxylate, hydrochloride, (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-oxo-2-phenylacetate hydrochloride, 8-Methyl-8-azabicyclo[3.2.1]octan-3-yl oxo(phenyl)acetate--hydrogen chloride (1/1)
| Molecular Formula | C16H20ClNO3 |
|---|---|
| Molecular Weight | 309.11 g/mol |
| LogP | 2.4595 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 309.11316 |
| Heavy Atoms | 21 |
| Complexity | 505.51318 |
Chemical Identifiers
| CAS Number | 64790-46-1 |
|---|---|
| SMILES | CN1C2CCC1CC(C2)OC(=O)C(=O)C3=CC=CC=C3.Cl |
Product Overview
Tropine phenylglyoxylate hydrochloride (CAS 64790-46-1), with molecular formula C16H20ClNO3 and molecular weight 309.11 g/mol. IUPAC: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-oxo-2-phenylacetate;hydrochloride.
Chemical Property Profile of Tropine phenylglyoxylate hydrochloride
Property Insights of Tropine phenylglyoxylate hydrochloride
The XLogP value of 2.4595 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tropine phenylglyoxylate hydrochloride. With a topological polar surface area (TPSA) of 46.61 Ų, Tropine phenylglyoxylate hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tropine phenylglyoxylate 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 Tropine phenylglyoxylate hydrochloride?
The CAS number of Tropine phenylglyoxylate hydrochloride is 64790-46-1.
What is the molecular formula of Tropine phenylglyoxylate hydrochloride?
The molecular formula of Tropine phenylglyoxylate hydrochloride is C16H20ClNO3.
What is the molecular weight of Tropine phenylglyoxylate hydrochloride?
The molecular weight of Tropine phenylglyoxylate hydrochloride is 309.11 g/mol.
Where can I buy Tropine phenylglyoxylate hydrochloride?
You can request a quote for Tropine phenylglyoxylate hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tropine phenylglyoxylate hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Tropine phenylglyoxylate hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.