Isopropyl hydroxyacetate
TL;DR: Isopropyl hydroxyacetate (CAS 623-61-0) is a chemical compound with molecular formula C5H10O3 and molecular weight 118.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 2-hydroxyacetate
Also Known As: ISOPROPYL GLYCOLATE, Isopropylglycolate, isopropyl 2-hydroxyacetate, propan-2-yl 2-hydroxyacetate, Isopropyl hydroxyacetate
| Molecular Formula | C5H10O3 |
|---|---|
| Molecular Weight | 118.06 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 118.062996 |
| Heavy Atoms | 8 |
| Complexity | 77.0 |
Chemical Identifiers
| CAS Number | 623-61-0 |
|---|---|
| SMILES | CC(C)OC(=O)CO |
| InChIKey | AZKIQQBSVTWCGY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Isopropyl hydroxyacetate (CAS 623-61-0), with molecular formula C5H10O3 and molecular weight 118.06 g/mol. IUPAC: propan-2-yl 2-hydroxyacetate.
Chemical Property Profile of Isopropyl hydroxyacetate
Property Insights of Isopropyl hydroxyacetate
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isopropyl hydroxyacetate. With a topological polar surface area (TPSA) of 46.5 Ų, Isopropyl hydroxyacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isopropyl hydroxyacetate 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 Isopropyl hydroxyacetate?
The CAS number of Isopropyl hydroxyacetate is 623-61-0.
What is the molecular formula of Isopropyl hydroxyacetate?
The molecular formula of Isopropyl hydroxyacetate is C5H10O3.
What is the molecular weight of Isopropyl hydroxyacetate?
The molecular weight of Isopropyl hydroxyacetate is 118.06 g/mol.
Where can I buy Isopropyl hydroxyacetate?
You can request a quote for Isopropyl hydroxyacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isopropyl hydroxyacetate?
Yes, KEHONG BIO provides custom synthesis services for Isopropyl hydroxyacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.