2-Hydroxyethyl (4-oxo-2-phenyl-4H-1-benzopyran-8-yl)acetate
TL;DR: 2-Hydroxyethyl (4-oxo-2-phenyl-4H-1-benzopyran-8-yl)acetate (CAS 87626-65-1) is a chemical compound with molecular formula C19H16O5 and molecular weight 324.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxyethyl 2-(4-oxo-2-phenylchromen-8-yl)acetate
Also Known As: 2-hydroxyethyl 2-(4-oxo-2-phenylchromen-8-yl)acetate, 2-Hydroxyethyl (4-oxo-2-phenyl-4H-1-benzopyran-8-yl)acetate, 4H-1-Benzopyran-8-acetic acid, 2-hydroxyethyl ester
| Molecular Formula | C19H16O5 |
|---|---|
| Molecular Weight | 324.10 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 72.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 324.09976 |
| Heavy Atoms | 24 |
| Complexity | 492.0 |
Chemical Identifiers
| CAS Number | 87626-65-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC(=O)C3=CC=CC(=C3O2)CC(=O)OCCO |
| InChIKey | IDQZOKQCVMACAV-UHFFFAOYSA-N |
Product Overview
2-Hydroxyethyl (4-oxo-2-phenyl-4H-1-benzopyran-8-yl)acetate (CAS 87626-65-1), with molecular formula C19H16O5 and molecular weight 324.10 g/mol. IUPAC: 2-hydroxyethyl 2-(4-oxo-2-phenylchromen-8-yl)acetate.
Chemical Property Profile of 2-Hydroxyethyl (4-oxo-2-phenyl-4H-1-benzopyran-8-yl)acetate
Property Insights of 2-Hydroxyethyl (4-oxo-2-phenyl-4H-1-benzopyran-8-yl)acetate
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Hydroxyethyl (4-oxo-2-phenyl-4H-1-benzopyran-8-yl)acetate. The TPSA of 72.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Hydroxyethyl (4-oxo-2-phenyl-4H-1-benzopyran-8-yl)acetate. Following Lipinski's Rule of Five, 2-Hydroxyethyl (4-oxo-2-phenyl-4H-1-benzopyran-8-yl)acetate has 1 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 2-Hydroxyethyl (4-oxo-2-phenyl-4H-1-benzopyran-8-yl)acetate?
The CAS number of 2-Hydroxyethyl (4-oxo-2-phenyl-4H-1-benzopyran-8-yl)acetate is 87626-65-1.
What is the molecular formula of 2-Hydroxyethyl (4-oxo-2-phenyl-4H-1-benzopyran-8-yl)acetate?
The molecular formula of 2-Hydroxyethyl (4-oxo-2-phenyl-4H-1-benzopyran-8-yl)acetate is C19H16O5.
What is the molecular weight of 2-Hydroxyethyl (4-oxo-2-phenyl-4H-1-benzopyran-8-yl)acetate?
The molecular weight of 2-Hydroxyethyl (4-oxo-2-phenyl-4H-1-benzopyran-8-yl)acetate is 324.10 g/mol.
Where can I buy 2-Hydroxyethyl (4-oxo-2-phenyl-4H-1-benzopyran-8-yl)acetate?
You can request a quote for 2-Hydroxyethyl (4-oxo-2-phenyl-4H-1-benzopyran-8-yl)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Hydroxyethyl (4-oxo-2-phenyl-4H-1-benzopyran-8-yl)acetate?
Yes, KEHONG BIO provides custom synthesis services for 2-Hydroxyethyl (4-oxo-2-phenyl-4H-1-benzopyran-8-yl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.