1,4-Benzodioxan, 2-morpholinomethyl-, hydrochloride
TL;DR: 1,4-Benzodioxan, 2-morpholinomethyl-, hydrochloride (CAS 53532-20-0) is a chemical compound with molecular formula C13H18ClNO3 and molecular weight 271.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)morpholin-4-ium chloride
Also Known As: 2-Morpholinomethyl-1,4-benzodioxan hydrochloride, 1,4-BENZODIOXAN, 2-MORPHOLINOMETHYL-, HYDROCHLORIDE, Morpholine, 4-(1,4-benzodioxan-2-ylmethyl)-, hydrochloride, Morpholine, 4-((2,3-dihydro-1,4-benzodioxin-2-yl)methyl)-, hydrochloride, 4-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)morpholin-4-ium chloride
| Molecular Formula | C13H18ClNO3 |
|---|---|
| Molecular Weight | 271.10 g/mol |
| LogP | -3.25 |
| Topological Polar Surface Area | 32.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 271.09753 |
| Heavy Atoms | 18 |
| Complexity | 243.0 |
Chemical Identifiers
| CAS Number | 53532-20-0 |
|---|---|
| SMILES | C1COCC[NH+]1CC2COC3=CC=CC=C3O2.[Cl-] |
| InChIKey | UOOQKFOABFHZMO-UHFFFAOYSA-N |
Product Overview
1,4-Benzodioxan, 2-morpholinomethyl-, hydrochloride (CAS 53532-20-0), with molecular formula C13H18ClNO3 and molecular weight 271.10 g/mol. IUPAC: 4-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)morpholin-4-ium chloride.
Chemical Property Profile of 1,4-Benzodioxan, 2-morpholinomethyl-, hydrochloride
Property Insights of 1,4-Benzodioxan, 2-morpholinomethyl-, hydrochloride
The XLogP value of -3.25 indicates that 1,4-Benzodioxan, 2-morpholinomethyl-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 32.1 Ų, 1,4-Benzodioxan, 2-morpholinomethyl-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Benzodioxan, 2-morpholinomethyl-, 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 1,4-Benzodioxan, 2-morpholinomethyl-, hydrochloride?
The CAS number of 1,4-Benzodioxan, 2-morpholinomethyl-, hydrochloride is 53532-20-0.
What is the molecular formula of 1,4-Benzodioxan, 2-morpholinomethyl-, hydrochloride?
The molecular formula of 1,4-Benzodioxan, 2-morpholinomethyl-, hydrochloride is C13H18ClNO3.
What is the molecular weight of 1,4-Benzodioxan, 2-morpholinomethyl-, hydrochloride?
The molecular weight of 1,4-Benzodioxan, 2-morpholinomethyl-, hydrochloride is 271.10 g/mol.
Where can I buy 1,4-Benzodioxan, 2-morpholinomethyl-, hydrochloride?
You can request a quote for 1,4-Benzodioxan, 2-morpholinomethyl-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Benzodioxan, 2-morpholinomethyl-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Benzodioxan, 2-morpholinomethyl-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.