Coumarin, 8-((diethylamino)methyl)-6,7-dihydroxy-, hydrochloride
TL;DR: Coumarin, 8-((diethylamino)methyl)-6,7-dihydroxy-, hydrochloride (CAS 92246-48-5) is a chemical compound with molecular formula C14H18ClNO4 and molecular weight 299.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6,7-dihydroxy-2-oxochromen-8-yl)methyl-diethylazanium chloride
Also Known As: 8-((Diethylamino)methyl)-6,7-dihydroxycoumarin hydrochloride, 3-Oxo-2-phenylacetylamino-butyric acid ethyl ester, COUMARIN, 8-((DIETHYLAMINO)METHYL)-6,7-DIHYDROXY-, HYDROCHLORIDE, (6,7-dihydroxy-2-oxochromen-8-yl)methyl-diethylazanium chloride, (6,7-dihydroxy-2-oxochromen-8-yl)methyl-diethylazanium,chloride
| Molecular Formula | C14H18ClNO4 |
|---|---|
| Molecular Weight | 299.09 g/mol |
| LogP | -2.3671 |
| Topological Polar Surface Area | 75.11 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 299.09244 |
| Heavy Atoms | 20 |
| Complexity | 649.39935 |
Chemical Identifiers
| CAS Number | 92246-48-5 |
|---|---|
| SMILES | CC[NH+](CC)CC1=C2C(=CC(=C1O)O)C=CC(=O)O2.[Cl-] |
Product Overview
Coumarin, 8-((diethylamino)methyl)-6,7-dihydroxy-, hydrochloride (CAS 92246-48-5), with molecular formula C14H18ClNO4 and molecular weight 299.09 g/mol. IUPAC: (6,7-dihydroxy-2-oxochromen-8-yl)methyl-diethylazanium chloride.
Chemical Property Profile of Coumarin, 8-((diethylamino)methyl)-6,7-dihydroxy-, hydrochloride
Property Insights of Coumarin, 8-((diethylamino)methyl)-6,7-dihydroxy-, hydrochloride
The XLogP value of -2.3671 indicates that Coumarin, 8-((diethylamino)methyl)-6,7-dihydroxy-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 75.11 Ų falls within the moderate polarity range, balancing permeability and solubility for Coumarin, 8-((diethylamino)methyl)-6,7-dihydroxy-, hydrochloride. Following Lipinski's Rule of Five, Coumarin, 8-((diethylamino)methyl)-6,7-dihydroxy-, hydrochloride has 3 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 Coumarin, 8-((diethylamino)methyl)-6,7-dihydroxy-, hydrochloride?
The CAS number of Coumarin, 8-((diethylamino)methyl)-6,7-dihydroxy-, hydrochloride is 92246-48-5.
What is the molecular formula of Coumarin, 8-((diethylamino)methyl)-6,7-dihydroxy-, hydrochloride?
The molecular formula of Coumarin, 8-((diethylamino)methyl)-6,7-dihydroxy-, hydrochloride is C14H18ClNO4.
What is the molecular weight of Coumarin, 8-((diethylamino)methyl)-6,7-dihydroxy-, hydrochloride?
The molecular weight of Coumarin, 8-((diethylamino)methyl)-6,7-dihydroxy-, hydrochloride is 299.09 g/mol.
Where can I buy Coumarin, 8-((diethylamino)methyl)-6,7-dihydroxy-, hydrochloride?
You can request a quote for Coumarin, 8-((diethylamino)methyl)-6,7-dihydroxy-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Coumarin, 8-((diethylamino)methyl)-6,7-dihydroxy-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Coumarin, 8-((diethylamino)methyl)-6,7-dihydroxy-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.