2-(Anilinomethyl)-4-tert-butylphenol
TL;DR: 2-(Anilinomethyl)-4-tert-butylphenol (CAS 6957-51-3) is a chemical compound with molecular formula C17H21NO and molecular weight 255.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(anilinomethyl)-4-tert-butylphenol
Also Known As: 2-(anilinomethyl)-4-tert-butylphenol, 4-tert-butyl-2-[(phenylamino)methyl]phenol
| Molecular Formula | C17H21NO |
|---|---|
| Molecular Weight | 255.16 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 32.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 255.16231 |
| Heavy Atoms | 19 |
| Complexity | 265.0 |
Chemical Identifiers
| CAS Number | 6957-51-3 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=C(C=C1)O)CNC2=CC=CC=C2 |
| InChIKey | HHMAIDLFFRHEBW-UHFFFAOYSA-N |
Product Overview
2-(Anilinomethyl)-4-tert-butylphenol (CAS 6957-51-3), with molecular formula C17H21NO and molecular weight 255.16 g/mol. IUPAC: 2-(anilinomethyl)-4-tert-butylphenol.
Chemical Property Profile of 2-(Anilinomethyl)-4-tert-butylphenol
Property Insights of 2-(Anilinomethyl)-4-tert-butylphenol
The XLogP value of 4.7 indicates that 2-(Anilinomethyl)-4-tert-butylphenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.3 Ų, 2-(Anilinomethyl)-4-tert-butylphenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Anilinomethyl)-4-tert-butylphenol has 2 hydrogen bond donor(s) and 2 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-(Anilinomethyl)-4-tert-butylphenol?
The CAS number of 2-(Anilinomethyl)-4-tert-butylphenol is 6957-51-3.
What is the molecular formula of 2-(Anilinomethyl)-4-tert-butylphenol?
The molecular formula of 2-(Anilinomethyl)-4-tert-butylphenol is C17H21NO.
What is the molecular weight of 2-(Anilinomethyl)-4-tert-butylphenol?
The molecular weight of 2-(Anilinomethyl)-4-tert-butylphenol is 255.16 g/mol.
Where can I buy 2-(Anilinomethyl)-4-tert-butylphenol?
You can request a quote for 2-(Anilinomethyl)-4-tert-butylphenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Anilinomethyl)-4-tert-butylphenol?
Yes, KEHONG BIO provides custom synthesis services for 2-(Anilinomethyl)-4-tert-butylphenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.