Methyl phenoxyacetate
TL;DR: Methyl phenoxyacetate (CAS 2065-23-8) is a chemical compound with molecular formula C9H10O3 and molecular weight 166.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-phenoxyacetate
Also Known As: methyl 2-phenoxyacetate, METHYL PHENOXYACETATE, Phenoxyacetic acid methyl ester, Methyl=phenoxyacetate, Hexachlorocyclopropane
| Molecular Formula | C9H10O3 |
|---|---|
| Molecular Weight | 166.06 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 166.06299 |
| Heavy Atoms | 12 |
| Complexity | 139.0 |
Chemical Identifiers
| CAS Number | 2065-23-8 |
|---|---|
| SMILES | COC(=O)COC1=CC=CC=C1 |
| InChIKey | BZCKRPHEZOHHBK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl phenoxyacetate (CAS 2065-23-8), with molecular formula C9H10O3 and molecular weight 166.06 g/mol. IUPAC: methyl 2-phenoxyacetate.
Chemical Property Profile of Methyl phenoxyacetate
Property Insights of Methyl phenoxyacetate
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl phenoxyacetate. With a topological polar surface area (TPSA) of 35.5 Ų, Methyl phenoxyacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl phenoxyacetate 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 Methyl phenoxyacetate?
The CAS number of Methyl phenoxyacetate is 2065-23-8.
What is the molecular formula of Methyl phenoxyacetate?
The molecular formula of Methyl phenoxyacetate is C9H10O3.
What is the molecular weight of Methyl phenoxyacetate?
The molecular weight of Methyl phenoxyacetate is 166.06 g/mol.
Where can I buy Methyl phenoxyacetate?
You can request a quote for Methyl phenoxyacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl phenoxyacetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl phenoxyacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.