4-Isobutyl-2-isopropylphenol
TL;DR: 4-Isobutyl-2-isopropylphenol (CAS 93804-61-6) is a chemical compound with molecular formula C13H20O and molecular weight 192.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-methylpropyl)-2-propan-2-ylphenol
Also Known As: 4-Isobutyl-2-isopropylphenol, EINECS 298-438-2, 4-(2-methylpropyl)-2-propan-2-ylphenol, 4-(2-methylpropyl)-2-(propan-2-yl)phenol, 2-(1-Methylethyl)-4-(2-methylpropyl)phenol
| Molecular Formula | C13H20O |
|---|---|
| Molecular Weight | 192.15 g/mol |
| LogP | 3.7141 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 192.15141 |
| Heavy Atoms | 14 |
| Complexity | 300.1039 |
Chemical Identifiers
| CAS Number | 93804-61-6 |
|---|---|
| SMILES | CC(C)CC1=CC(=C(C=C1)O)C(C)C |
Product Overview
4-Isobutyl-2-isopropylphenol (CAS 93804-61-6), with molecular formula C13H20O and molecular weight 192.15 g/mol. IUPAC: 4-(2-methylpropyl)-2-propan-2-ylphenol.
Chemical Property Profile of 4-Isobutyl-2-isopropylphenol
Property Insights of 4-Isobutyl-2-isopropylphenol
The XLogP value of 3.7141 indicates that 4-Isobutyl-2-isopropylphenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.23 Ų, 4-Isobutyl-2-isopropylphenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Isobutyl-2-isopropylphenol has 1 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-Isobutyl-2-isopropylphenol?
The CAS number of 4-Isobutyl-2-isopropylphenol is 93804-61-6.
What is the molecular formula of 4-Isobutyl-2-isopropylphenol?
The molecular formula of 4-Isobutyl-2-isopropylphenol is C13H20O.
What is the molecular weight of 4-Isobutyl-2-isopropylphenol?
The molecular weight of 4-Isobutyl-2-isopropylphenol is 192.15 g/mol.
Where can I buy 4-Isobutyl-2-isopropylphenol?
You can request a quote for 4-Isobutyl-2-isopropylphenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Isobutyl-2-isopropylphenol?
Yes, KEHONG BIO provides custom synthesis services for 4-Isobutyl-2-isopropylphenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.