4-Butoxybiphenyl
TL;DR: 4-Butoxybiphenyl (CAS 79825-63-1) is a chemical compound with molecular formula C16H18O and molecular weight 226.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-butoxy-4-phenylbenzene
Also Known As: 4-Butoxybiphenyl, p-n-Butoxybiphenyl, 4-Butoxy-1,1'-biphenyl, 1-butoxy-4-phenylbenzene, 4-Butoxy-biphenyl
| Molecular Formula | C16H18O |
|---|---|
| Molecular Weight | 226.14 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 226.13577 |
| Heavy Atoms | 17 |
| Complexity | 188.0 |
Chemical Identifiers
| CAS Number | 79825-63-1 |
|---|---|
| SMILES | CCCCOC1=CC=C(C=C1)C2=CC=CC=C2 |
| InChIKey | NCJZHZJABHDELF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Butoxybiphenyl (CAS 79825-63-1), with molecular formula C16H18O and molecular weight 226.14 g/mol. IUPAC: 1-butoxy-4-phenylbenzene.
Chemical Property Profile of 4-Butoxybiphenyl
Property Insights of 4-Butoxybiphenyl
The XLogP value of 4.8 indicates that 4-Butoxybiphenyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, 4-Butoxybiphenyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Butoxybiphenyl 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 4-Butoxybiphenyl?
The CAS number of 4-Butoxybiphenyl is 79825-63-1.
What is the molecular formula of 4-Butoxybiphenyl?
The molecular formula of 4-Butoxybiphenyl is C16H18O.
What is the molecular weight of 4-Butoxybiphenyl?
The molecular weight of 4-Butoxybiphenyl is 226.14 g/mol.
Where can I buy 4-Butoxybiphenyl?
You can request a quote for 4-Butoxybiphenyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Butoxybiphenyl?
Yes, KEHONG BIO provides custom synthesis services for 4-Butoxybiphenyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.