2-(4-Methyl-1-oxopentyl)furan
TL;DR: 2-(4-Methyl-1-oxopentyl)furan (CAS 78072-59-0) is a chemical compound with molecular formula C10H14O2 and molecular weight 166.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(furan-2-yl)-4-methylpentan-1-one
Also Known As: 1-Pentanone, 1-(2-furanyl)-4-methyl-, 2-(4-methylvaleryl)furan, 2-(4-Methyl-1-oxopentyl)furan, 1-(furan-2-yl)-4-methylpentan-1-one, 1-(2-Furanyl)-4-methylpentan-1-one
| Molecular Formula | C10H14O2 |
|---|---|
| Molecular Weight | 166.10 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 30.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 166.09938 |
| Heavy Atoms | 12 |
| Complexity | 152.0 |
Chemical Identifiers
| CAS Number | 78072-59-0 |
|---|---|
| SMILES | CC(C)CCC(=O)C1=CC=CO1 |
| InChIKey | SCZPAWWSCDSDKR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(4-Methyl-1-oxopentyl)furan (CAS 78072-59-0), with molecular formula C10H14O2 and molecular weight 166.10 g/mol. IUPAC: 1-(furan-2-yl)-4-methylpentan-1-one.
Chemical Property Profile of 2-(4-Methyl-1-oxopentyl)furan
Property Insights of 2-(4-Methyl-1-oxopentyl)furan
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Methyl-1-oxopentyl)furan. With a topological polar surface area (TPSA) of 30.2 Ų, 2-(4-Methyl-1-oxopentyl)furan exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Methyl-1-oxopentyl)furan has 0 hydrogen bond donor(s) and 2 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 2-(4-Methyl-1-oxopentyl)furan?
The CAS number of 2-(4-Methyl-1-oxopentyl)furan is 78072-59-0.
What is the molecular formula of 2-(4-Methyl-1-oxopentyl)furan?
The molecular formula of 2-(4-Methyl-1-oxopentyl)furan is C10H14O2.
What is the molecular weight of 2-(4-Methyl-1-oxopentyl)furan?
The molecular weight of 2-(4-Methyl-1-oxopentyl)furan is 166.10 g/mol.
Where can I buy 2-(4-Methyl-1-oxopentyl)furan?
You can request a quote for 2-(4-Methyl-1-oxopentyl)furan directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Methyl-1-oxopentyl)furan?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Methyl-1-oxopentyl)furan and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.