Pentyl furoate
TL;DR: Pentyl furoate (CAS 1334-82-3) is a chemical compound with molecular formula C10H14O3 and molecular weight 182.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pentyl furan-2-carboxylate
Also Known As: Amyl 2-furoate, Pentyl furoate, Pentyl 2-furoate, Amyl furoate, pentyl furan-2-carboxylate
| Molecular Formula | C10H14O3 |
|---|---|
| Molecular Weight | 182.09 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 39.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 182.0943 |
| Heavy Atoms | 13 |
| Complexity | 156.0 |
| Density | 1.031-1.038 |
| Solubility | insoluble in water |
| Refractive Index | 1.469-1.475 |
Chemical Identifiers
| CAS Number | 1334-82-3 |
|---|---|
| SMILES | CCCCCOC(=O)C1=CC=CO1 |
| InChIKey | BGJZMKPSRLHMME-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pentyl furoate (CAS 1334-82-3), with molecular formula C10H14O3 and molecular weight 182.09 g/mol. IUPAC: pentyl furan-2-carboxylate.
Chemical Property Profile of Pentyl furoate
Property Insights of Pentyl furoate
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pentyl furoate. With a topological polar surface area (TPSA) of 39.4 Ų, Pentyl furoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pentyl furoate 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 Pentyl furoate?
The CAS number of Pentyl furoate is 1334-82-3.
What is the molecular formula of Pentyl furoate?
The molecular formula of Pentyl furoate is C10H14O3.
What is the molecular weight of Pentyl furoate?
The molecular weight of Pentyl furoate is 182.09 g/mol.
Where can I buy Pentyl furoate?
You can request a quote for Pentyl furoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pentyl furoate?
Yes, KEHONG BIO provides custom synthesis services for Pentyl furoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.