4-Amino-2,3,6-trimethylphenol
TL;DR: 4-Amino-2,3,6-trimethylphenol (CAS 17959-06-7) is a chemical compound with molecular formula C9H13NO and molecular weight 151.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-2,3,6-trimethylphenol
Also Known As: 4-amino-2,3,6-trimethylphenol, Phenol,3,6-trimethyl-, 4-Hydroxy-2,3,5-trimethylaniline, Cc1c(N)cc(C)c(O)c1C, Phenol, 4-amino-2,3,6-trimethyl-
| Molecular Formula | C9H13NO |
|---|---|
| Molecular Weight | 151.10 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 46.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 151.09972 |
| Heavy Atoms | 11 |
| Complexity | 138.0 |
Chemical Identifiers
| CAS Number | 17959-06-7 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1O)C)C)N |
| InChIKey | OZIFWVTUTMBIOH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Amino-2,3,6-trimethylphenol (CAS 17959-06-7), with molecular formula C9H13NO and molecular weight 151.10 g/mol. IUPAC: 4-amino-2,3,6-trimethylphenol.
Chemical Property Profile of 4-Amino-2,3,6-trimethylphenol
Property Insights of 4-Amino-2,3,6-trimethylphenol
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Amino-2,3,6-trimethylphenol. With a topological polar surface area (TPSA) of 46.3 Ų, 4-Amino-2,3,6-trimethylphenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Amino-2,3,6-trimethylphenol 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 4-Amino-2,3,6-trimethylphenol?
The CAS number of 4-Amino-2,3,6-trimethylphenol is 17959-06-7.
What is the molecular formula of 4-Amino-2,3,6-trimethylphenol?
The molecular formula of 4-Amino-2,3,6-trimethylphenol is C9H13NO.
What is the molecular weight of 4-Amino-2,3,6-trimethylphenol?
The molecular weight of 4-Amino-2,3,6-trimethylphenol is 151.10 g/mol.
Where can I buy 4-Amino-2,3,6-trimethylphenol?
You can request a quote for 4-Amino-2,3,6-trimethylphenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Amino-2,3,6-trimethylphenol?
Yes, KEHONG BIO provides custom synthesis services for 4-Amino-2,3,6-trimethylphenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.