Acetic acid, ((2-ethyl-3-methyl-4-oxo-4H-1-benzopyran-7-yl)oxy)-, ethyl ester
TL;DR: Acetic acid, ((2-ethyl-3-methyl-4-oxo-4H-1-benzopyran-7-yl)oxy)-, ethyl ester (CAS 102585-54-6) is a chemical compound with molecular formula C16H18O5 and molecular weight 290.11542 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 2-(2-ethyl-3-methyl-4-oxochromen-7-yl)oxyacetate
Also Known As: REC 1-0182, 2-Etil-3-metilcromon-7-ossiacetato di etile, REC-1-0182, 2-Etil-3-metilcromon-7-ossiacetato di etile [Italian], 4-18-00-00400 (Beilstein Handbook Reference)
Technical Specifications
| Molecular Formula | C16H18O5 |
| Molecular Weight | 290.11542 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 61.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 290.11542 Da |
| Heavy Atoms | 21 |
| Complexity | 440.0 |
| SMILES | CCC1=C(C(=O)C2=C(O1)C=C(C=C2)OCC(=O)OCC)C |
| InChIKey | XHZYQBPCJJASPQ-UHFFFAOYSA-N |
Chemical Property Profile of Acetic acid, ((2-ethyl-3-methyl-4-oxo-4H-1-benzopyran-7-yl)oxy)-, ethyl ester
Property Insights of Acetic acid, ((2-ethyl-3-methyl-4-oxo-4H-1-benzopyran-7-yl)oxy)-, ethyl ester
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetic acid, ((2-ethyl-3-methyl-4-oxo-4H-1-benzopyran-7-yl)oxy)-, ethyl ester. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetic acid, ((2-ethyl-3-methyl-4-oxo-4H-1-benzopyran-7-yl)oxy)-, ethyl ester. Following Lipinski's Rule of Five, Acetic acid, ((2-ethyl-3-methyl-4-oxo-4H-1-benzopyran-7-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
What is the CAS number of Acetic acid, ((2-ethyl-3-methyl-4-oxo-4H-1-benzopyran-7-yl)oxy)-, ethyl ester?
The CAS number of Acetic acid, ((2-ethyl-3-methyl-4-oxo-4H-1-benzopyran-7-yl)oxy)-, ethyl ester is 102585-54-6.
What is the molecular formula of Acetic acid, ((2-ethyl-3-methyl-4-oxo-4H-1-benzopyran-7-yl)oxy)-, ethyl ester?
The molecular formula of Acetic acid, ((2-ethyl-3-methyl-4-oxo-4H-1-benzopyran-7-yl)oxy)-, ethyl ester is C16H18O5.
What is the molecular weight of Acetic acid, ((2-ethyl-3-methyl-4-oxo-4H-1-benzopyran-7-yl)oxy)-, ethyl ester?
The molecular weight of Acetic acid, ((2-ethyl-3-methyl-4-oxo-4H-1-benzopyran-7-yl)oxy)-, ethyl ester is 290.11542 g/mol.
Where can I buy Acetic acid, ((2-ethyl-3-methyl-4-oxo-4H-1-benzopyran-7-yl)oxy)-, ethyl ester?
You can request a quote for Acetic acid, ((2-ethyl-3-methyl-4-oxo-4H-1-benzopyran-7-yl)oxy)-, ethyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Acetic acid, ((2-ethyl-3-methyl-4-oxo-4H-1-benzopyran-7-yl)oxy)-, ethyl ester?
Yes, CoreyChem provides custom synthesis services for Acetic acid, ((2-ethyl-3-methyl-4-oxo-4H-1-benzopyran-7-yl)oxy)-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.