3,6-Dimethyl-2-(prop-2-en-1-yl)phenol
TL;DR: 3,6-Dimethyl-2-(prop-2-en-1-yl)phenol (CAS 42365-73-1) is a chemical compound with molecular formula C11H14O and molecular weight 162.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,6-dimethyl-2-prop-2-enylphenol
Also Known As: 2-Allyl-3,6-dimethylphenol, 3,6-dimethyl-2-(prop-2-en-1-yl)phenol, 3,6-Dimethyl-2-allylphenol, 3,6-dimethyl-2-prop-2-enylphenol, 3,6-dimethyl-2-prop-2-enyl-phenol
| Molecular Formula | C11H14O |
|---|---|
| Molecular Weight | 162.10 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 162.10446 |
| Heavy Atoms | 12 |
| Complexity | 153.0 |
Chemical Identifiers
| CAS Number | 42365-73-1 |
|---|---|
| SMILES | CC1=C(C(=C(C=C1)C)O)CC=C |
| InChIKey | OPXKDTAJJMNIHI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,6-Dimethyl-2-(prop-2-en-1-yl)phenol (CAS 42365-73-1), with molecular formula C11H14O and molecular weight 162.10 g/mol. IUPAC: 3,6-dimethyl-2-prop-2-enylphenol.
Chemical Property Profile of 3,6-Dimethyl-2-(prop-2-en-1-yl)phenol
Property Insights of 3,6-Dimethyl-2-(prop-2-en-1-yl)phenol
The XLogP value of 3.4 indicates that 3,6-Dimethyl-2-(prop-2-en-1-yl)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, 3,6-Dimethyl-2-(prop-2-en-1-yl)phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,6-Dimethyl-2-(prop-2-en-1-yl)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 3,6-Dimethyl-2-(prop-2-en-1-yl)phenol?
The CAS number of 3,6-Dimethyl-2-(prop-2-en-1-yl)phenol is 42365-73-1.
What is the molecular formula of 3,6-Dimethyl-2-(prop-2-en-1-yl)phenol?
The molecular formula of 3,6-Dimethyl-2-(prop-2-en-1-yl)phenol is C11H14O.
What is the molecular weight of 3,6-Dimethyl-2-(prop-2-en-1-yl)phenol?
The molecular weight of 3,6-Dimethyl-2-(prop-2-en-1-yl)phenol is 162.10 g/mol.
Where can I buy 3,6-Dimethyl-2-(prop-2-en-1-yl)phenol?
You can request a quote for 3,6-Dimethyl-2-(prop-2-en-1-yl)phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,6-Dimethyl-2-(prop-2-en-1-yl)phenol?
Yes, KEHONG BIO provides custom synthesis services for 3,6-Dimethyl-2-(prop-2-en-1-yl)phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.