Ethyl 2,5-Dihydroxyphenylacetate
TL;DR: Ethyl 2,5-Dihydroxyphenylacetate (CAS 76196-46-8) is a chemical compound with molecular formula C10H12O4 and molecular weight 196.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(2,5-dihydroxyphenyl)acetate
Also Known As: ethyl homogentisate, ethyl 2-(2,5-dihydroxyphenyl)acetate, ETHYL 2,5-DIHYDROXYPHENYLACETATE, ethyl (2,5-dihydroxyphenyl)acetate, 2,5-Dihydroxyphenylacetic acid ethyl ester
| Molecular Formula | C10H12O4 |
|---|---|
| Molecular Weight | 196.07 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 196.07356 |
| Heavy Atoms | 14 |
| Complexity | 193.0 |
Chemical Identifiers
| CAS Number | 76196-46-8 |
|---|---|
| SMILES | CCOC(=O)CC1=C(C=CC(=C1)O)O |
| InChIKey | QTMILHTUDCGNJF-UHFFFAOYSA-N |
Product Overview
Ethyl 2,5-Dihydroxyphenylacetate (CAS 76196-46-8), with molecular formula C10H12O4 and molecular weight 196.07 g/mol. IUPAC: ethyl 2-(2,5-dihydroxyphenyl)acetate.
Chemical Property Profile of Ethyl 2,5-Dihydroxyphenylacetate
Property Insights of Ethyl 2,5-Dihydroxyphenylacetate
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2,5-Dihydroxyphenylacetate. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2,5-Dihydroxyphenylacetate. Following Lipinski's Rule of Five, Ethyl 2,5-Dihydroxyphenylacetate has 2 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 Ethyl 2,5-Dihydroxyphenylacetate?
The CAS number of Ethyl 2,5-Dihydroxyphenylacetate is 76196-46-8.
What is the molecular formula of Ethyl 2,5-Dihydroxyphenylacetate?
The molecular formula of Ethyl 2,5-Dihydroxyphenylacetate is C10H12O4.
What is the molecular weight of Ethyl 2,5-Dihydroxyphenylacetate?
The molecular weight of Ethyl 2,5-Dihydroxyphenylacetate is 196.07 g/mol.
Where can I buy Ethyl 2,5-Dihydroxyphenylacetate?
You can request a quote for Ethyl 2,5-Dihydroxyphenylacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2,5-Dihydroxyphenylacetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2,5-Dihydroxyphenylacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.