Tetrahydrofurfuryl benzoate
TL;DR: Tetrahydrofurfuryl benzoate (CAS 2217-32-5) is a chemical compound with molecular formula C12H14O3 and molecular weight 206.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
oxolan-2-ylmethyl benzoate
Also Known As: Triapenthenol, TETRAHYDROFURFURYL BENZOATE, 1-Aminotetralin, oxolan-2-ylmethyl benzoate, Tetrahydrofurfurylbenzoate
| Molecular Formula | C12H14O3 |
|---|---|
| Molecular Weight | 206.09 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 206.0943 |
| Heavy Atoms | 15 |
| Complexity | 209.0 |
Chemical Identifiers
| CAS Number | 2217-32-5 |
|---|---|
| SMILES | C1CC(OC1)COC(=O)C2=CC=CC=C2 |
| InChIKey | ZXVLLZARPGZABO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Tetrahydrofurfuryl benzoate (CAS 2217-32-5), with molecular formula C12H14O3 and molecular weight 206.09 g/mol. IUPAC: oxolan-2-ylmethyl benzoate.
Chemical Property Profile of Tetrahydrofurfuryl benzoate
Property Insights of Tetrahydrofurfuryl benzoate
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tetrahydrofurfuryl benzoate. With a topological polar surface area (TPSA) of 35.5 Ų, Tetrahydrofurfuryl benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tetrahydrofurfuryl benzoate 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 Tetrahydrofurfuryl benzoate?
The CAS number of Tetrahydrofurfuryl benzoate is 2217-32-5.
What is the molecular formula of Tetrahydrofurfuryl benzoate?
The molecular formula of Tetrahydrofurfuryl benzoate is C12H14O3.
What is the molecular weight of Tetrahydrofurfuryl benzoate?
The molecular weight of Tetrahydrofurfuryl benzoate is 206.09 g/mol.
Where can I buy Tetrahydrofurfuryl benzoate?
You can request a quote for Tetrahydrofurfuryl benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tetrahydrofurfuryl benzoate?
Yes, KEHONG BIO provides custom synthesis services for Tetrahydrofurfuryl benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.