1-Methylethyl 2-methoxyacetate
TL;DR: 1-Methylethyl 2-methoxyacetate (CAS 17640-21-0) is a chemical compound with molecular formula C6H12O3 and molecular weight 132.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 2-methoxyacetate
Also Known As: isopropyl 2-methoxyacetate, Isopropyl methoxyacetate, propan-2-yl 2-methoxyacetate, propan-2-yl methoxyacetate, Isopropylmethoxyacetate
| Molecular Formula | C6H12O3 |
|---|---|
| Molecular Weight | 132.08 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 132.07864 |
| Heavy Atoms | 9 |
| Complexity | 88.0 |
Chemical Identifiers
| CAS Number | 17640-21-0 |
|---|---|
| SMILES | CC(C)OC(=O)COC |
| InChIKey | XYXFJNIUUWEUIJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Methylethyl 2-methoxyacetate (CAS 17640-21-0), with molecular formula C6H12O3 and molecular weight 132.08 g/mol. IUPAC: propan-2-yl 2-methoxyacetate.
Chemical Property Profile of 1-Methylethyl 2-methoxyacetate
Property Insights of 1-Methylethyl 2-methoxyacetate
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methylethyl 2-methoxyacetate. With a topological polar surface area (TPSA) of 35.5 Ų, 1-Methylethyl 2-methoxyacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methylethyl 2-methoxyacetate 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 1-Methylethyl 2-methoxyacetate?
The CAS number of 1-Methylethyl 2-methoxyacetate is 17640-21-0.
What is the molecular formula of 1-Methylethyl 2-methoxyacetate?
The molecular formula of 1-Methylethyl 2-methoxyacetate is C6H12O3.
What is the molecular weight of 1-Methylethyl 2-methoxyacetate?
The molecular weight of 1-Methylethyl 2-methoxyacetate is 132.08 g/mol.
Where can I buy 1-Methylethyl 2-methoxyacetate?
You can request a quote for 1-Methylethyl 2-methoxyacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methylethyl 2-methoxyacetate?
Yes, KEHONG BIO provides custom synthesis services for 1-Methylethyl 2-methoxyacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.