2-Isopentylfuran
TL;DR: 2-Isopentylfuran (CAS 15012-77-8) is a chemical compound with molecular formula C9H14O and molecular weight 138.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-methylbutyl)furan
Also Known As: 2-isoamylfuran, 2-isopentylfuran, 2-(3-methylbutyl)furan
| Molecular Formula | C9H14O |
|---|---|
| Molecular Weight | 138.10 g/mol |
| LogP | 2.8682 |
| Topological Polar Surface Area | 13.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 138.10446 |
| Heavy Atoms | 10 |
| Complexity | 162.86377 |
Chemical Identifiers
| CAS Number | 15012-77-8 |
|---|---|
| SMILES | CC(C)CCC1=CC=CO1 |
Product Overview
2-Isopentylfuran (CAS 15012-77-8), with molecular formula C9H14O and molecular weight 138.10 g/mol. IUPAC: 2-(3-methylbutyl)furan.
Chemical Property Profile of 2-Isopentylfuran
Property Insights of 2-Isopentylfuran
The XLogP value of 2.8682 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Isopentylfuran. With a topological polar surface area (TPSA) of 13.14 Ų, 2-Isopentylfuran exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Isopentylfuran has 0 hydrogen bond donor(s) and 1 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-Isopentylfuran?
The CAS number of 2-Isopentylfuran is 15012-77-8.
What is the molecular formula of 2-Isopentylfuran?
The molecular formula of 2-Isopentylfuran is C9H14O.
What is the molecular weight of 2-Isopentylfuran?
The molecular weight of 2-Isopentylfuran is 138.10 g/mol.
Where can I buy 2-Isopentylfuran?
You can request a quote for 2-Isopentylfuran directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Isopentylfuran?
Yes, KEHONG BIO provides custom synthesis services for 2-Isopentylfuran and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.