Acetic acid, ((2,3-dimethyl-4-oxo-4H-1-benzopyran-6-yl)oxy)-, ethyl ester
TL;DR: Acetic acid, ((2,3-dimethyl-4-oxo-4H-1-benzopyran-6-yl)oxy)-, ethyl ester (CAS 102585-48-8) is a chemical compound with molecular formula C15H16O5 and molecular weight 276.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(2,3-dimethyl-4-oxochromen-6-yl)oxyacetate
Also Known As: REC 1-0179, 2,3-Dimetilcromon-6-ossiacetato di etile, REC-1-0179, 2,3-Dimetilcromon-6-ossiacetato di etile [Italian], 4-18-00-00373 (Beilstein Handbook Reference)
| Molecular Formula | C15H16O5 |
|---|---|
| Molecular Weight | 276.10 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 276.09976 |
| Heavy Atoms | 20 |
| Complexity | 426.0 |
Chemical Identifiers
| CAS Number | 102585-48-8 |
|---|---|
| SMILES | CCOC(=O)COC1=CC2=C(C=C1)OC(=C(C2=O)C)C |
| InChIKey | HIOMRFQRXYMQIK-UHFFFAOYSA-N |
Product Overview
Acetic acid, ((2,3-dimethyl-4-oxo-4H-1-benzopyran-6-yl)oxy)-, ethyl ester (CAS 102585-48-8), with molecular formula C15H16O5 and molecular weight 276.10 g/mol. IUPAC: ethyl 2-(2,3-dimethyl-4-oxochromen-6-yl)oxyacetate.
Chemical Property Profile of Acetic acid, ((2,3-dimethyl-4-oxo-4H-1-benzopyran-6-yl)oxy)-, ethyl ester
Property Insights of Acetic acid, ((2,3-dimethyl-4-oxo-4H-1-benzopyran-6-yl)oxy)-, ethyl ester
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetic acid, ((2,3-dimethyl-4-oxo-4H-1-benzopyran-6-yl)oxy)-, ethyl ester. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetic acid, ((2,3-dimethyl-4-oxo-4H-1-benzopyran-6-yl)oxy)-, ethyl ester. Following Lipinski's Rule of Five, Acetic acid, ((2,3-dimethyl-4-oxo-4H-1-benzopyran-6-yl)oxy)-, ethyl ester 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 Acetic acid, ((2,3-dimethyl-4-oxo-4H-1-benzopyran-6-yl)oxy)-, ethyl ester?
The CAS number of Acetic acid, ((2,3-dimethyl-4-oxo-4H-1-benzopyran-6-yl)oxy)-, ethyl ester is 102585-48-8.
What is the molecular formula of Acetic acid, ((2,3-dimethyl-4-oxo-4H-1-benzopyran-6-yl)oxy)-, ethyl ester?
The molecular formula of Acetic acid, ((2,3-dimethyl-4-oxo-4H-1-benzopyran-6-yl)oxy)-, ethyl ester is C15H16O5.
What is the molecular weight of Acetic acid, ((2,3-dimethyl-4-oxo-4H-1-benzopyran-6-yl)oxy)-, ethyl ester?
The molecular weight of Acetic acid, ((2,3-dimethyl-4-oxo-4H-1-benzopyran-6-yl)oxy)-, ethyl ester is 276.10 g/mol.
Where can I buy Acetic acid, ((2,3-dimethyl-4-oxo-4H-1-benzopyran-6-yl)oxy)-, ethyl ester?
You can request a quote for Acetic acid, ((2,3-dimethyl-4-oxo-4H-1-benzopyran-6-yl)oxy)-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid, ((2,3-dimethyl-4-oxo-4H-1-benzopyran-6-yl)oxy)-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid, ((2,3-dimethyl-4-oxo-4H-1-benzopyran-6-yl)oxy)-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.