乙酸四氢糠酯
TL;DR: 乙酸四氢糠酯 (CAS 637-64-9) is a chemical compound with molecular formula C7H12O3 and molecular weight 144.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
乙酸四氢糠酯
oxolan-2-ylmethyl acetate
Also Known As: TETRAHYDROFURFURYL ACETATE, 2-Acetoxymethyloxolane, oxolan-2-ylmethyl acetate, (Tetrahydrofuran-2-yl)methyl acetate, 2-(Acetoxymethyl)tetrahydrofuran
| Molecular Formula | C7H12O3 |
|---|---|
| Molecular Weight | 144.08 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 144.07864 |
| Heavy Atoms | 10 |
| Complexity | 122.0 |
| Boiling Point | 194.00 to 195.00 °C. @ 753.00 mm Hg |
| Density | 1.058-1.064 |
| Solubility | Soluble in water, ether, chloroform |
| Refractive Index | 1.435-1.440 |
Chemical Identifiers
| CAS Number | 637-64-9 |
|---|---|
| SMILES | CC(=O)OCC1CCCO1 |
| InChIKey | AAQDYYFAFXGBFZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
乙酸四氢糠酯 (CAS 637-64-9), with molecular formula C7H12O3 and molecular weight 144.08 g/mol. IUPAC: oxolan-2-ylmethyl acetate.
Chemical Property Profile of 乙酸四氢糠酯
Property Insights of 乙酸四氢糠酯
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 乙酸四氢糠酯. With a topological polar surface area (TPSA) of 35.5 Ų, 乙酸四氢糠酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 乙酸四氢糠酯 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 乙酸四氢糠酯?
The CAS number of 乙酸四氢糠酯 is 637-64-9.
What is the molecular formula of 乙酸四氢糠酯?
The molecular formula of 乙酸四氢糠酯 is C7H12O3.
What is the molecular weight of 乙酸四氢糠酯?
The molecular weight of 乙酸四氢糠酯 is 144.08 g/mol.
Where can I buy 乙酸四氢糠酯?
You can request a quote for 乙酸四氢糠酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 乙酸四氢糠酯?
Yes, KEHONG BIO provides custom synthesis services for 乙酸四氢糠酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.