2-Methyl-3-(2-methylbutyl)phenol
TL;DR: 2-Methyl-3-(2-methylbutyl)phenol (CAS 1322-30-1) is a chemical compound with molecular formula C12H18O and molecular weight 178.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-3-(2-methylbutyl)phenol
Also Known As: 2-methyl-3-(2-methylbutyl)phenol, Phenol, 2-methyl(2-methylbutyl)-, 2-METHYL-BUTYL-ORTHOCRESOL, Phenol, 2-methyl(2-methylbutyl)- (9CI)
| Molecular Formula | C12H18O |
|---|---|
| Molecular Weight | 178.14 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 178.13577 |
| Heavy Atoms | 13 |
| Complexity | 144.0 |
Chemical Identifiers
| CAS Number | 1322-30-1 |
|---|---|
| SMILES | CCC(C)CC1=C(C(=CC=C1)O)C |
| InChIKey | LFJZBYSEVYSNNT-UHFFFAOYSA-N |
Product Overview
2-Methyl-3-(2-methylbutyl)phenol (CAS 1322-30-1), with molecular formula C12H18O and molecular weight 178.14 g/mol. IUPAC: 2-methyl-3-(2-methylbutyl)phenol.
Chemical Property Profile of 2-Methyl-3-(2-methylbutyl)phenol
Property Insights of 2-Methyl-3-(2-methylbutyl)phenol
The XLogP value of 4.1 indicates that 2-Methyl-3-(2-methylbutyl)phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 2-Methyl-3-(2-methylbutyl)phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-3-(2-methylbutyl)phenol 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 2-Methyl-3-(2-methylbutyl)phenol?
The CAS number of 2-Methyl-3-(2-methylbutyl)phenol is 1322-30-1.
What is the molecular formula of 2-Methyl-3-(2-methylbutyl)phenol?
The molecular formula of 2-Methyl-3-(2-methylbutyl)phenol is C12H18O.
What is the molecular weight of 2-Methyl-3-(2-methylbutyl)phenol?
The molecular weight of 2-Methyl-3-(2-methylbutyl)phenol is 178.14 g/mol.
Where can I buy 2-Methyl-3-(2-methylbutyl)phenol?
You can request a quote for 2-Methyl-3-(2-methylbutyl)phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-3-(2-methylbutyl)phenol?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-3-(2-methylbutyl)phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.