2-Propenoic acid, 3-(2,5-dihydroxyphenyl)-, 2-phenylethyl ester
TL;DR: 2-Propenoic acid, 3-(2,5-dihydroxyphenyl)-, 2-phenylethyl ester (CAS 169232-11-5) is a chemical compound with molecular formula C17H16O4 and molecular weight 284.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-phenylethyl 3-(2,5-dihydroxyphenyl)prop-2-enoate
Also Known As: phenethyl 3-(2,5-dihydroxyphenyl)prop-2-enoate, 2-phenylethyl 3-(2,5-dihydroxyphenyl)prop-2-enoate, 2-Propenoic acid, 3-(2,5-dihydroxyphenyl)-, 2-phenylethyl ester
| Molecular Formula | C17H16O4 |
|---|---|
| Molecular Weight | 284.10 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 284.10486 |
| Heavy Atoms | 21 |
| Complexity | 347.0 |
Chemical Identifiers
| CAS Number | 169232-11-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCOC(=O)C=CC2=C(C=CC(=C2)O)O |
| InChIKey | OQKRMXDGEFRBAJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Propenoic acid, 3-(2,5-dihydroxyphenyl)-, 2-phenylethyl ester (CAS 169232-11-5), with molecular formula C17H16O4 and molecular weight 284.10 g/mol. IUPAC: 2-phenylethyl 3-(2,5-dihydroxyphenyl)prop-2-enoate.
Chemical Property Profile of 2-Propenoic acid, 3-(2,5-dihydroxyphenyl)-, 2-phenylethyl ester
Property Insights of 2-Propenoic acid, 3-(2,5-dihydroxyphenyl)-, 2-phenylethyl ester
The XLogP value of 3.4 indicates that 2-Propenoic acid, 3-(2,5-dihydroxyphenyl)-, 2-phenylethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Propenoic acid, 3-(2,5-dihydroxyphenyl)-, 2-phenylethyl ester. Following Lipinski's Rule of Five, 2-Propenoic acid, 3-(2,5-dihydroxyphenyl)-, 2-phenylethyl ester 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 2-Propenoic acid, 3-(2,5-dihydroxyphenyl)-, 2-phenylethyl ester?
The CAS number of 2-Propenoic acid, 3-(2,5-dihydroxyphenyl)-, 2-phenylethyl ester is 169232-11-5.
What is the molecular formula of 2-Propenoic acid, 3-(2,5-dihydroxyphenyl)-, 2-phenylethyl ester?
The molecular formula of 2-Propenoic acid, 3-(2,5-dihydroxyphenyl)-, 2-phenylethyl ester is C17H16O4.
What is the molecular weight of 2-Propenoic acid, 3-(2,5-dihydroxyphenyl)-, 2-phenylethyl ester?
The molecular weight of 2-Propenoic acid, 3-(2,5-dihydroxyphenyl)-, 2-phenylethyl ester is 284.10 g/mol.
Where can I buy 2-Propenoic acid, 3-(2,5-dihydroxyphenyl)-, 2-phenylethyl ester?
You can request a quote for 2-Propenoic acid, 3-(2,5-dihydroxyphenyl)-, 2-phenylethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propenoic acid, 3-(2,5-dihydroxyphenyl)-, 2-phenylethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2-Propenoic acid, 3-(2,5-dihydroxyphenyl)-, 2-phenylethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.