Acetic acid, 2-hydroxy-, 2-phenylethyl ester
TL;DR: Acetic acid, 2-hydroxy-, 2-phenylethyl ester (CAS 72928-38-2) is a chemical compound with molecular formula C10H12O3 and molecular weight 180.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-phenylethyl 2-hydroxyacetate
Also Known As: phenethyl 2-hydroxyacetate, 2-Phenylethyl hydroxyacetate, Glycolic acid, phenethyl ester, 2-phenylethyl 2-hydroxyacetate, Acetic acid, hydroxy-, 2-phenylethyl ester
| Molecular Formula | C10H12O3 |
|---|---|
| Molecular Weight | 180.08 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 180.07864 |
| Heavy Atoms | 13 |
| Complexity | 150.0 |
Chemical Identifiers
| CAS Number | 72928-38-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCOC(=O)CO |
| InChIKey | GCWBOYJHPSTLAU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Acetic acid, 2-hydroxy-, 2-phenylethyl ester (CAS 72928-38-2), with molecular formula C10H12O3 and molecular weight 180.08 g/mol. IUPAC: 2-phenylethyl 2-hydroxyacetate.
Chemical Property Profile of Acetic acid, 2-hydroxy-, 2-phenylethyl ester
Property Insights of Acetic acid, 2-hydroxy-, 2-phenylethyl ester
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetic acid, 2-hydroxy-, 2-phenylethyl ester. With a topological polar surface area (TPSA) of 46.5 Ų, Acetic acid, 2-hydroxy-, 2-phenylethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetic acid, 2-hydroxy-, 2-phenylethyl ester has 1 hydrogen bond donor(s) and 3 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-hydroxy-, 2-phenylethyl ester?
The CAS number of Acetic acid, 2-hydroxy-, 2-phenylethyl ester is 72928-38-2.
What is the molecular formula of Acetic acid, 2-hydroxy-, 2-phenylethyl ester?
The molecular formula of Acetic acid, 2-hydroxy-, 2-phenylethyl ester is C10H12O3.
What is the molecular weight of Acetic acid, 2-hydroxy-, 2-phenylethyl ester?
The molecular weight of Acetic acid, 2-hydroxy-, 2-phenylethyl ester is 180.08 g/mol.
Where can I buy Acetic acid, 2-hydroxy-, 2-phenylethyl ester?
You can request a quote for Acetic acid, 2-hydroxy-, 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 Acetic acid, 2-hydroxy-, 2-phenylethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid, 2-hydroxy-, 2-phenylethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.