Phenol, 4-(1,1-dimethylethyl)-2-(1-phenylethyl)-
TL;DR: Phenol, 4-(1,1-dimethylethyl)-2-(1-phenylethyl)- (CAS 1806-32-2) is a chemical compound with molecular formula C18H22O and molecular weight 254.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-tert-butyl-2-(1-phenylethyl)phenol
Also Known As: 4-tert-butyl-2-(1-phenylethyl)phenol, 2-(1-phenylethyl)-4-t-butylphenol, Phenol, 4-(1,1-dimethylethyl)-2-(1-phenylethyl)-, 2-(1-Phenylethyl)-4-tert-butylphenol, AI3-25190
| Molecular Formula | C18H22O |
|---|---|
| Molecular Weight | 254.17 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 254.16707 |
| Heavy Atoms | 19 |
| Complexity | 272.0 |
Chemical Identifiers
| CAS Number | 1806-32-2 |
|---|---|
| SMILES | CC(C1=CC=CC=C1)C2=C(C=CC(=C2)C(C)(C)C)O |
| InChIKey | JVJMRLZNFIEHGR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Phenol, 4-(1,1-dimethylethyl)-2-(1-phenylethyl)- (CAS 1806-32-2), with molecular formula C18H22O and molecular weight 254.17 g/mol. IUPAC: 4-tert-butyl-2-(1-phenylethyl)phenol.
Chemical Property Profile of Phenol, 4-(1,1-dimethylethyl)-2-(1-phenylethyl)-
Property Insights of Phenol, 4-(1,1-dimethylethyl)-2-(1-phenylethyl)-
The XLogP value of 5.5 indicates that Phenol, 4-(1,1-dimethylethyl)-2-(1-phenylethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, Phenol, 4-(1,1-dimethylethyl)-2-(1-phenylethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenol, 4-(1,1-dimethylethyl)-2-(1-phenylethyl)- has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Phenol, 4-(1,1-dimethylethyl)-2-(1-phenylethyl)-?
The CAS number of Phenol, 4-(1,1-dimethylethyl)-2-(1-phenylethyl)- is 1806-32-2.
What is the molecular formula of Phenol, 4-(1,1-dimethylethyl)-2-(1-phenylethyl)-?
The molecular formula of Phenol, 4-(1,1-dimethylethyl)-2-(1-phenylethyl)- is C18H22O.
What is the molecular weight of Phenol, 4-(1,1-dimethylethyl)-2-(1-phenylethyl)-?
The molecular weight of Phenol, 4-(1,1-dimethylethyl)-2-(1-phenylethyl)- is 254.17 g/mol.
Where can I buy Phenol, 4-(1,1-dimethylethyl)-2-(1-phenylethyl)-?
You can request a quote for Phenol, 4-(1,1-dimethylethyl)-2-(1-phenylethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenol, 4-(1,1-dimethylethyl)-2-(1-phenylethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Phenol, 4-(1,1-dimethylethyl)-2-(1-phenylethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.