Chromone-2-carboxylic acid, 8-(diethylaminomethyl)-7-hydroxy-, ethyl ester, hydrochloride
TL;DR: Chromone-2-carboxylic acid, 8-(diethylaminomethyl)-7-hydroxy-, ethyl ester, hydrochloride (CAS 53708-74-0) is a chemical compound with molecular formula C17H22ClNO5 and molecular weight 355.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 8-(diethylaminomethyl)-7-hydroxy-4-oxochromene-2-carboxylate;hydrochloride
Also Known As: Chromone-2-carboxylic acid, 8-(diethylaminomethyl)-7-hydroxy-, ethyl ester, hydrochloride, 7-Hydroxy-8-(diethylaminoethyl)chromone-2-carboxylic acid ethyl ester hydrochloride, ethyl 8-(diethylaminomethyl)-7-hydroxy-4-oxochromene-2-carboxylate hydrochloride, Ethyl 8-[(diethylamino)methyl]-7-hydroxy-4-oxo-4H-1-benzopyran-2-carboxylate--hydrogen chloride (1/1), RefChem:334113
| Molecular Formula | C17H22ClNO5 |
|---|---|
| Molecular Weight | 355.12 g/mol |
| LogP | 2.9389 |
| Topological Polar Surface Area | 79.98 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 355.11865 |
| Heavy Atoms | 24 |
| Complexity | 767.4003 |
Chemical Identifiers
| CAS Number | 53708-74-0 |
|---|---|
| SMILES | CCN(CC)CC1=C(C=CC2=C1OC(=CC2=O)C(=O)OCC)O.Cl |
Product Overview
Chromone-2-carboxylic acid, 8-(diethylaminomethyl)-7-hydroxy-, ethyl ester, hydrochloride (CAS 53708-74-0), with molecular formula C17H22ClNO5 and molecular weight 355.12 g/mol. IUPAC: ethyl 8-(diethylaminomethyl)-7-hydroxy-4-oxochromene-2-carboxylate;hydrochloride.
Chemical Property Profile of Chromone-2-carboxylic acid, 8-(diethylaminomethyl)-7-hydroxy-, ethyl ester, hydrochloride
Property Insights of Chromone-2-carboxylic acid, 8-(diethylaminomethyl)-7-hydroxy-, ethyl ester, hydrochloride
The XLogP value of 2.9389 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Chromone-2-carboxylic acid, 8-(diethylaminomethyl)-7-hydroxy-, ethyl ester, hydrochloride. The TPSA of 79.98 Ų falls within the moderate polarity range, balancing permeability and solubility for Chromone-2-carboxylic acid, 8-(diethylaminomethyl)-7-hydroxy-, ethyl ester, hydrochloride. Following Lipinski's Rule of Five, Chromone-2-carboxylic acid, 8-(diethylaminomethyl)-7-hydroxy-, ethyl ester, hydrochloride has 1 hydrogen bond donor(s) and 6 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 Chromone-2-carboxylic acid, 8-(diethylaminomethyl)-7-hydroxy-, ethyl ester, hydrochloride?
The CAS number of Chromone-2-carboxylic acid, 8-(diethylaminomethyl)-7-hydroxy-, ethyl ester, hydrochloride is 53708-74-0.
What is the molecular formula of Chromone-2-carboxylic acid, 8-(diethylaminomethyl)-7-hydroxy-, ethyl ester, hydrochloride?
The molecular formula of Chromone-2-carboxylic acid, 8-(diethylaminomethyl)-7-hydroxy-, ethyl ester, hydrochloride is C17H22ClNO5.
What is the molecular weight of Chromone-2-carboxylic acid, 8-(diethylaminomethyl)-7-hydroxy-, ethyl ester, hydrochloride?
The molecular weight of Chromone-2-carboxylic acid, 8-(diethylaminomethyl)-7-hydroxy-, ethyl ester, hydrochloride is 355.12 g/mol.
Where can I buy Chromone-2-carboxylic acid, 8-(diethylaminomethyl)-7-hydroxy-, ethyl ester, hydrochloride?
You can request a quote for Chromone-2-carboxylic acid, 8-(diethylaminomethyl)-7-hydroxy-, ethyl ester, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Chromone-2-carboxylic acid, 8-(diethylaminomethyl)-7-hydroxy-, ethyl ester, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Chromone-2-carboxylic acid, 8-(diethylaminomethyl)-7-hydroxy-, ethyl ester, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.