4-Methyl-4-(3-p-tolyl-propoxycarbonylmethyl)-morpholin-4-ium
TL;DR: 4-Methyl-4-(3-p-tolyl-propoxycarbonylmethyl)-morpholin-4-ium (CAS 1025027-97-7) is a chemical compound with molecular formula C17H26INO3 and molecular weight 419.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-methylphenyl)propyl 2-(4-methylmorpholin-4-ium-4-yl)acetate iodide
Also Known As: 4-methyl-4-(2-oxo-2-(3-(p-tolyl)propoxy)ethyl)morpholin-4-ium iodide, 4-Methyl-4-(3-p-tolyl-propoxycarbonylmethyl)-morpholin-4-ium
| Molecular Formula | C17H26INO3 |
|---|---|
| Molecular Weight | 419.10 g/mol |
| LogP | -1.04838 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 419.09573 |
| Heavy Atoms | 22 |
| Complexity | 455.47678 |
Chemical Identifiers
| CAS Number | 1025027-97-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CCCOC(=O)C[N+]2(CCOCC2)C.[I-] |
Product Overview
4-Methyl-4-(3-p-tolyl-propoxycarbonylmethyl)-morpholin-4-ium (CAS 1025027-97-7), with molecular formula C17H26INO3 and molecular weight 419.10 g/mol. IUPAC: 3-(4-methylphenyl)propyl 2-(4-methylmorpholin-4-ium-4-yl)acetate iodide.
Chemical Property Profile of 4-Methyl-4-(3-p-tolyl-propoxycarbonylmethyl)-morpholin-4-ium
Property Insights of 4-Methyl-4-(3-p-tolyl-propoxycarbonylmethyl)-morpholin-4-ium
The XLogP value of -1.04838 indicates that 4-Methyl-4-(3-p-tolyl-propoxycarbonylmethyl)-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 35.53 Ų, 4-Methyl-4-(3-p-tolyl-propoxycarbonylmethyl)-morpholin-4-ium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methyl-4-(3-p-tolyl-propoxycarbonylmethyl)-morpholin-4-ium has 0 hydrogen bond donor(s) and 3 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 4-Methyl-4-(3-p-tolyl-propoxycarbonylmethyl)-morpholin-4-ium?
The CAS number of 4-Methyl-4-(3-p-tolyl-propoxycarbonylmethyl)-morpholin-4-ium is 1025027-97-7.
What is the molecular formula of 4-Methyl-4-(3-p-tolyl-propoxycarbonylmethyl)-morpholin-4-ium?
The molecular formula of 4-Methyl-4-(3-p-tolyl-propoxycarbonylmethyl)-morpholin-4-ium is C17H26INO3.
What is the molecular weight of 4-Methyl-4-(3-p-tolyl-propoxycarbonylmethyl)-morpholin-4-ium?
The molecular weight of 4-Methyl-4-(3-p-tolyl-propoxycarbonylmethyl)-morpholin-4-ium is 419.10 g/mol.
Where can I buy 4-Methyl-4-(3-p-tolyl-propoxycarbonylmethyl)-morpholin-4-ium?
You can request a quote for 4-Methyl-4-(3-p-tolyl-propoxycarbonylmethyl)-morpholin-4-ium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methyl-4-(3-p-tolyl-propoxycarbonylmethyl)-morpholin-4-ium?
Yes, KEHONG BIO provides custom synthesis services for 4-Methyl-4-(3-p-tolyl-propoxycarbonylmethyl)-morpholin-4-ium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.