2,6-Ditert-butyl-4-(2-pyridin-3-ylethenyl)phenol
TL;DR: 2,6-Ditert-butyl-4-(2-pyridin-3-ylethenyl)phenol (CAS 116376-62-6) is a chemical compound with molecular formula C21H27NO and molecular weight 309.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-ditert-butyl-4-(2-pyridin-3-ylethenyl)phenol
Also Known As: 2,3-Di-t-butyl-4-(2-(3-pyridyl)ethenyl)phenol, 2,6-Ditert-butyl-4-(2-pyridin-3-ylethenyl)phenol, 2,6-Di-tert-butyl-4-(2-(3-pyridinyl)ethenyl)phenol, Phenol,2,6-bis(1,1-dimethylethyl)-4-[2-(3-pyridinyl)ethenyl]-, 2,6-Bis(1,1-dimethylethyl)-4-(2-(3-pyridinyl)ethenyl)phenol
| Molecular Formula | C21H27NO |
|---|---|
| Molecular Weight | 309.21 g/mol |
| LogP | 6.1 |
| Topological Polar Surface Area | 33.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 309.20926 |
| Heavy Atoms | 23 |
| Complexity | 377.0 |
Chemical Identifiers
| CAS Number | 116376-62-6 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C=CC2=CN=CC=C2 |
| InChIKey | LMLDPXXCYIXDSG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,6-Ditert-butyl-4-(2-pyridin-3-ylethenyl)phenol (CAS 116376-62-6), with molecular formula C21H27NO and molecular weight 309.21 g/mol. IUPAC: 2,6-ditert-butyl-4-(2-pyridin-3-ylethenyl)phenol.
Chemical Property Profile of 2,6-Ditert-butyl-4-(2-pyridin-3-ylethenyl)phenol
Property Insights of 2,6-Ditert-butyl-4-(2-pyridin-3-ylethenyl)phenol
The XLogP value of 6.1 indicates that 2,6-Ditert-butyl-4-(2-pyridin-3-ylethenyl)phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 33.1 Ų, 2,6-Ditert-butyl-4-(2-pyridin-3-ylethenyl)phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Ditert-butyl-4-(2-pyridin-3-ylethenyl)phenol has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,6-Ditert-butyl-4-(2-pyridin-3-ylethenyl)phenol?
The CAS number of 2,6-Ditert-butyl-4-(2-pyridin-3-ylethenyl)phenol is 116376-62-6.
What is the molecular formula of 2,6-Ditert-butyl-4-(2-pyridin-3-ylethenyl)phenol?
The molecular formula of 2,6-Ditert-butyl-4-(2-pyridin-3-ylethenyl)phenol is C21H27NO.
What is the molecular weight of 2,6-Ditert-butyl-4-(2-pyridin-3-ylethenyl)phenol?
The molecular weight of 2,6-Ditert-butyl-4-(2-pyridin-3-ylethenyl)phenol is 309.21 g/mol.
Where can I buy 2,6-Ditert-butyl-4-(2-pyridin-3-ylethenyl)phenol?
You can request a quote for 2,6-Ditert-butyl-4-(2-pyridin-3-ylethenyl)phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Ditert-butyl-4-(2-pyridin-3-ylethenyl)phenol?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Ditert-butyl-4-(2-pyridin-3-ylethenyl)phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.