3,5-Dimethyl-2,6-bis(1-methylethyl)phenol
TL;DR: 3,5-Dimethyl-2,6-bis(1-methylethyl)phenol (CAS 60834-77-7) is a chemical compound with molecular formula C14H22O and molecular weight 206.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dimethyl-2,6-di(propan-2-yl)phenol
Also Known As: 2,6-Diisopropyl-3,5-xylenol, 2,6-Diisopropyl-3,5-dimethylphenol, Phenol, 2,6-diisopropyl-3,5-dimethyl-, 3,5-dimethyl-2,6-di(propan-2-yl)phenol, 3,5-dimethyl-2,6-bis(propan-2-yl)phenol
| Molecular Formula | C14H22O |
|---|---|
| Molecular Weight | 206.17 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 206.16707 |
| Heavy Atoms | 15 |
| Complexity | 178.0 |
Chemical Identifiers
| CAS Number | 60834-77-7 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1C(C)C)O)C(C)C)C |
| InChIKey | BSRNBFQSPKHHOR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,5-Dimethyl-2,6-bis(1-methylethyl)phenol (CAS 60834-77-7), with molecular formula C14H22O and molecular weight 206.17 g/mol. IUPAC: 3,5-dimethyl-2,6-di(propan-2-yl)phenol.
Chemical Property Profile of 3,5-Dimethyl-2,6-bis(1-methylethyl)phenol
Property Insights of 3,5-Dimethyl-2,6-bis(1-methylethyl)phenol
The XLogP value of 4.5 indicates that 3,5-Dimethyl-2,6-bis(1-methylethyl)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, 3,5-Dimethyl-2,6-bis(1-methylethyl)phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-Dimethyl-2,6-bis(1-methylethyl)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 3,5-Dimethyl-2,6-bis(1-methylethyl)phenol?
The CAS number of 3,5-Dimethyl-2,6-bis(1-methylethyl)phenol is 60834-77-7.
What is the molecular formula of 3,5-Dimethyl-2,6-bis(1-methylethyl)phenol?
The molecular formula of 3,5-Dimethyl-2,6-bis(1-methylethyl)phenol is C14H22O.
What is the molecular weight of 3,5-Dimethyl-2,6-bis(1-methylethyl)phenol?
The molecular weight of 3,5-Dimethyl-2,6-bis(1-methylethyl)phenol is 206.17 g/mol.
Where can I buy 3,5-Dimethyl-2,6-bis(1-methylethyl)phenol?
You can request a quote for 3,5-Dimethyl-2,6-bis(1-methylethyl)phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Dimethyl-2,6-bis(1-methylethyl)phenol?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Dimethyl-2,6-bis(1-methylethyl)phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.