Morpholine, 4-ethyl-, 4-methylbenzenesulfonate (1:1)
TL;DR: Morpholine, 4-ethyl-, 4-methylbenzenesulfonate (1:1) (CAS 68738-85-2) is a chemical compound with molecular formula C13H20NO4S- and molecular weight 286.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-ethylmorpholine;4-methylbenzenesulfonate
Also Known As: p-Toluenesulfonic acid, N-ethylmorpholine salt, 4-ethylmorpholine; 4-methylbenzenesulfonate, Morpholine, 4-ethyl-, 4-methylbenzenesulfonate, 4-Ethylmorpholinium 4-methylbenzene-1-sulphonate, 4-ethylmorpholine;4-methylbenzenesulfonic acid
| Molecular Formula | C13H20NO4S- |
|---|---|
| Molecular Weight | 286.11 g/mol |
| LogP | 1.24 |
| Topological Polar Surface Area | 78.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 286.1113 |
| Heavy Atoms | 19 |
| Complexity | 253.0 |
Chemical Identifiers
| CAS Number | 68738-85-2 |
|---|---|
| SMILES | CCN1CCOCC1.CC1=CC=C(C=C1)S(=O)(=O)[O-] |
| InChIKey | WZNAQJZHNGXMOZ-UHFFFAOYSA-M |
Product Overview
Morpholine, 4-ethyl-, 4-methylbenzenesulfonate (1:1) (CAS 68738-85-2), with molecular formula C13H20NO4S- and molecular weight 286.11 g/mol. IUPAC: 4-ethylmorpholine;4-methylbenzenesulfonate.
Chemical Property Profile of Morpholine, 4-ethyl-, 4-methylbenzenesulfonate (1:1)
Property Insights of Morpholine, 4-ethyl-, 4-methylbenzenesulfonate (1:1)
The XLogP value of 1.24 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Morpholine, 4-ethyl-, 4-methylbenzenesulfonate (1:1). The TPSA of 78.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Morpholine, 4-ethyl-, 4-methylbenzenesulfonate (1:1). Following Lipinski's Rule of Five, Morpholine, 4-ethyl-, 4-methylbenzenesulfonate (1:1) has 0 hydrogen bond donor(s) and 5 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 Morpholine, 4-ethyl-, 4-methylbenzenesulfonate (1:1)?
The CAS number of Morpholine, 4-ethyl-, 4-methylbenzenesulfonate (1:1) is 68738-85-2.
What is the molecular formula of Morpholine, 4-ethyl-, 4-methylbenzenesulfonate (1:1)?
The molecular formula of Morpholine, 4-ethyl-, 4-methylbenzenesulfonate (1:1) is C13H20NO4S-.
What is the molecular weight of Morpholine, 4-ethyl-, 4-methylbenzenesulfonate (1:1)?
The molecular weight of Morpholine, 4-ethyl-, 4-methylbenzenesulfonate (1:1) is 286.11 g/mol.
Where can I buy Morpholine, 4-ethyl-, 4-methylbenzenesulfonate (1:1)?
You can request a quote for Morpholine, 4-ethyl-, 4-methylbenzenesulfonate (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Morpholine, 4-ethyl-, 4-methylbenzenesulfonate (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Morpholine, 4-ethyl-, 4-methylbenzenesulfonate (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.