2-Butylbenzofuran
TL;DR: 2-Butylbenzofuran (CAS 4265-27-4) is a chemical compound with molecular formula C12H14O and molecular weight 174.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-butyl-1-benzofuran
Also Known As: 2-Butylbenzofuran, 2-Butyl-1-benzofuran, Benzofuran, 2-butyl-, 2-n-Butylbenzo[b]furan, butylbenzofuran
| Molecular Formula | C12H14O |
|---|---|
| Molecular Weight | 174.10 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 13.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 174.10446 |
| Heavy Atoms | 13 |
| Complexity | 155.0 |
Chemical Identifiers
| CAS Number | 4265-27-4 |
|---|---|
| SMILES | CCCCC1=CC2=CC=CC=C2O1 |
| InChIKey | OVJKFJDEVKABNF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Butylbenzofuran (CAS 4265-27-4), with molecular formula C12H14O and molecular weight 174.10 g/mol. IUPAC: 2-butyl-1-benzofuran.
Chemical Property Profile of 2-Butylbenzofuran
Property Insights of 2-Butylbenzofuran
The XLogP value of 4.1 indicates that 2-Butylbenzofuran is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 13.1 Ų, 2-Butylbenzofuran exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Butylbenzofuran 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-Butylbenzofuran?
The CAS number of 2-Butylbenzofuran is 4265-27-4.
What is the molecular formula of 2-Butylbenzofuran?
The molecular formula of 2-Butylbenzofuran is C12H14O.
What is the molecular weight of 2-Butylbenzofuran?
The molecular weight of 2-Butylbenzofuran is 174.10 g/mol.
Where can I buy 2-Butylbenzofuran?
You can request a quote for 2-Butylbenzofuran directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Butylbenzofuran?
Yes, KEHONG BIO provides custom synthesis services for 2-Butylbenzofuran and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.