2-Methoxy-2-phenylacetate
TL;DR: 2-Methoxy-2-phenylacetate (CAS 85617-90-9) is a chemical compound with molecular formula C9H9O3- and molecular weight 165.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methoxy-2-phenylacetate
Also Known As: 2-methoxy-2-phenylacetate, 2-methoxy-2-phenylacetic acid, Methoxy-phenyl-acetic acid anion
| Molecular Formula | C9H9O3- |
|---|---|
| Molecular Weight | 165.06 g/mol |
| LogP | 0.124 |
| Topological Polar Surface Area | 49.36 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 165.05518 |
| Heavy Atoms | 12 |
| Complexity | 255.73598 |
Chemical Identifiers
| CAS Number | 85617-90-9 |
|---|---|
| SMILES | COC(C1=CC=CC=C1)C(=O)[O-] |
Product Overview
2-Methoxy-2-phenylacetate (CAS 85617-90-9), with molecular formula C9H9O3- and molecular weight 165.06 g/mol. IUPAC: 2-methoxy-2-phenylacetate.
Chemical Property Profile of 2-Methoxy-2-phenylacetate
Property Insights of 2-Methoxy-2-phenylacetate
The XLogP value of 0.124 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methoxy-2-phenylacetate. With a topological polar surface area (TPSA) of 49.36 Ų, 2-Methoxy-2-phenylacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methoxy-2-phenylacetate has 0 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 2-Methoxy-2-phenylacetate?
The CAS number of 2-Methoxy-2-phenylacetate is 85617-90-9.
What is the molecular formula of 2-Methoxy-2-phenylacetate?
The molecular formula of 2-Methoxy-2-phenylacetate is C9H9O3-.
What is the molecular weight of 2-Methoxy-2-phenylacetate?
The molecular weight of 2-Methoxy-2-phenylacetate is 165.06 g/mol.
Where can I buy 2-Methoxy-2-phenylacetate?
You can request a quote for 2-Methoxy-2-phenylacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methoxy-2-phenylacetate?
Yes, KEHONG BIO provides custom synthesis services for 2-Methoxy-2-phenylacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.