4-(3-Benzyloxy-2-phenylacetoxy-propyl)-4-methyl-morpholin-4-ium
TL;DR: 4-(3-Benzyloxy-2-phenylacetoxy-propyl)-4-methyl-morpholin-4-ium (CAS 129438-87-5) is a chemical compound with molecular formula C23H30INO4 and molecular weight 511.12195 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[1-(4-methylmorpholin-4-ium-4-yl)-3-phenylmethoxypropan-2-yl] 2-phenylacetate iodide
Also Known As: 4-(3-(benzyloxy)-2-(2-phenylacetoxy)propyl)-4-methylmorpholin-4-ium iodide, 4-(3-Benzyloxy-2-phenylacetoxy-propyl)-4-methyl-morpholin-4-ium
Technical Specifications
| Molecular Formula | C23H30INO4 |
| Molecular Weight | 511.12195 g/mol |
| XLogP | -0.1615 |
| Topological Polar Surface Area (TPSA) | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 511.12195 Da |
| Heavy Atoms | 29 |
| Complexity | 452.0 |
| SMILES | C[N+]1(CCOCC1)CC(COCC2=CC=CC=C2)OC(=O)CC3=CC=CC=C3.[I-] |
| InChIKey | WHKOVRYMLZEVCC-UHFFFAOYSA-M |
Chemical Property Profile of 4-(3-Benzyloxy-2-phenylacetoxy-propyl)-4-methyl-morpholin-4-ium
Property Insights of 4-(3-Benzyloxy-2-phenylacetoxy-propyl)-4-methyl-morpholin-4-ium
The XLogP value of -0.1615 indicates that 4-(3-Benzyloxy-2-phenylacetoxy-propyl)-4-methyl-morpholin-4-ium is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 44.8 Ų, 4-(3-Benzyloxy-2-phenylacetoxy-propyl)-4-methyl-morpholin-4-ium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(3-Benzyloxy-2-phenylacetoxy-propyl)-4-methyl-morpholin-4-ium has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 4-(3-Benzyloxy-2-phenylacetoxy-propyl)-4-methyl-morpholin-4-ium?
The CAS number of 4-(3-Benzyloxy-2-phenylacetoxy-propyl)-4-methyl-morpholin-4-ium is 129438-87-5.
What is the molecular formula of 4-(3-Benzyloxy-2-phenylacetoxy-propyl)-4-methyl-morpholin-4-ium?
The molecular formula of 4-(3-Benzyloxy-2-phenylacetoxy-propyl)-4-methyl-morpholin-4-ium is C23H30INO4.
What is the molecular weight of 4-(3-Benzyloxy-2-phenylacetoxy-propyl)-4-methyl-morpholin-4-ium?
The molecular weight of 4-(3-Benzyloxy-2-phenylacetoxy-propyl)-4-methyl-morpholin-4-ium is 511.12195 g/mol.
Where can I buy 4-(3-Benzyloxy-2-phenylacetoxy-propyl)-4-methyl-morpholin-4-ium?
You can request a quote for 4-(3-Benzyloxy-2-phenylacetoxy-propyl)-4-methyl-morpholin-4-ium directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(3-Benzyloxy-2-phenylacetoxy-propyl)-4-methyl-morpholin-4-ium?
Yes, CoreyChem provides custom synthesis services for 4-(3-Benzyloxy-2-phenylacetoxy-propyl)-4-methyl-morpholin-4-ium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.