Ethyl isopropoxyacetate
TL;DR: Ethyl isopropoxyacetate (CAS 42415-64-5) is a chemical compound with molecular formula C7H14O3 and molecular weight 146.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-propan-2-yloxyacetate
Also Known As: ethyl 2-(propan-2-yloxy)acetate, Ethyl isopropoxyacetate, ethyl 2-propan-2-yloxyacetate, ethyl isopropoxy-acetate, Ethyl 2-isopropoxyacetate
| Molecular Formula | C7H14O3 |
|---|---|
| Molecular Weight | 146.09 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 146.0943 |
| Heavy Atoms | 10 |
| Complexity | 99.0 |
Chemical Identifiers
| CAS Number | 42415-64-5 |
|---|---|
| SMILES | CCOC(=O)COC(C)C |
| InChIKey | JECQALZMHMNOLO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl isopropoxyacetate (CAS 42415-64-5), with molecular formula C7H14O3 and molecular weight 146.09 g/mol. IUPAC: ethyl 2-propan-2-yloxyacetate.
Chemical Property Profile of Ethyl isopropoxyacetate
Property Insights of Ethyl isopropoxyacetate
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl isopropoxyacetate. With a topological polar surface area (TPSA) of 35.5 Ų, Ethyl isopropoxyacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl isopropoxyacetate 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 Ethyl isopropoxyacetate?
The CAS number of Ethyl isopropoxyacetate is 42415-64-5.
What is the molecular formula of Ethyl isopropoxyacetate?
The molecular formula of Ethyl isopropoxyacetate is C7H14O3.
What is the molecular weight of Ethyl isopropoxyacetate?
The molecular weight of Ethyl isopropoxyacetate is 146.09 g/mol.
Where can I buy Ethyl isopropoxyacetate?
You can request a quote for Ethyl isopropoxyacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl isopropoxyacetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl isopropoxyacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.