3-Butoxyphenol
TL;DR: 3-Butoxyphenol (CAS 18979-72-1) 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.
3-butoxyphenol
Also Known As: 3-Butoxyphenol, Phenol, 3-butoxy-, 4-n-Butoxyphenol, m-butoxyphenol, butoxyphenol
| Molecular Formula | C10H14O2 |
|---|---|
| Molecular Weight | 166.10 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 166.09938 |
| Heavy Atoms | 12 |
| Complexity | 114.0 |
Chemical Identifiers
| CAS Number | 18979-72-1 |
|---|---|
| SMILES | CCCCOC1=CC=CC(=C1)O |
| InChIKey | VGIJZDWQVCXVNL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Butoxyphenol (CAS 18979-72-1), with molecular formula C10H14O2 and molecular weight 166.10 g/mol. IUPAC: 3-butoxyphenol.
Chemical Property Profile of 3-Butoxyphenol
Property Insights of 3-Butoxyphenol
The XLogP value of 3.0 indicates that 3-Butoxyphenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, 3-Butoxyphenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Butoxyphenol has 1 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 3-Butoxyphenol?
The CAS number of 3-Butoxyphenol is 18979-72-1.
What is the molecular formula of 3-Butoxyphenol?
The molecular formula of 3-Butoxyphenol is C10H14O2.
What is the molecular weight of 3-Butoxyphenol?
The molecular weight of 3-Butoxyphenol is 166.10 g/mol.
Where can I buy 3-Butoxyphenol?
You can request a quote for 3-Butoxyphenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Butoxyphenol?
Yes, KEHONG BIO provides custom synthesis services for 3-Butoxyphenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.