2-Amino-6-(2H-1,2,3-benzotriazol-2-yl)-4-methylphenol
TL;DR: 2-Amino-6-(2H-1,2,3-benzotriazol-2-yl)-4-methylphenol (CAS 52357-20-7) is a chemical compound with molecular formula C13H12N4O and molecular weight 240.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-6-(benzotriazol-2-yl)-4-methylphenol
Also Known As: 2-Amino-6-(2H-1,2,3-benzotriazol-2-yl)-4-methylphenol, 2-Amino-6-(2H-benzo[d][1,2,3]triazol-2-yl)-4-methylphenol, 2-amino-6-(benzotriazol-2-yl)-4-methylphenol, 2-Amino-6-benzotriazol-2-yl-4-methyl-phenol, J2.189.843K
| Molecular Formula | C13H12N4O |
|---|---|
| Molecular Weight | 240.10 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 77.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 240.1011 |
| Heavy Atoms | 18 |
| Complexity | 287.0 |
Chemical Identifiers
| CAS Number | 52357-20-7 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)N2N=C3C=CC=CC3=N2)O)N |
| InChIKey | WZIPHCOCDNRROA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Amino-6-(2H-1,2,3-benzotriazol-2-yl)-4-methylphenol (CAS 52357-20-7), with molecular formula C13H12N4O and molecular weight 240.10 g/mol. IUPAC: 2-amino-6-(benzotriazol-2-yl)-4-methylphenol.
Chemical Property Profile of 2-Amino-6-(2H-1,2,3-benzotriazol-2-yl)-4-methylphenol
Property Insights of 2-Amino-6-(2H-1,2,3-benzotriazol-2-yl)-4-methylphenol
The XLogP value of 3.6 indicates that 2-Amino-6-(2H-1,2,3-benzotriazol-2-yl)-4-methylphenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Amino-6-(2H-1,2,3-benzotriazol-2-yl)-4-methylphenol. Following Lipinski's Rule of Five, 2-Amino-6-(2H-1,2,3-benzotriazol-2-yl)-4-methylphenol has 2 hydrogen bond donor(s) and 4 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-Amino-6-(2H-1,2,3-benzotriazol-2-yl)-4-methylphenol?
The CAS number of 2-Amino-6-(2H-1,2,3-benzotriazol-2-yl)-4-methylphenol is 52357-20-7.
What is the molecular formula of 2-Amino-6-(2H-1,2,3-benzotriazol-2-yl)-4-methylphenol?
The molecular formula of 2-Amino-6-(2H-1,2,3-benzotriazol-2-yl)-4-methylphenol is C13H12N4O.
What is the molecular weight of 2-Amino-6-(2H-1,2,3-benzotriazol-2-yl)-4-methylphenol?
The molecular weight of 2-Amino-6-(2H-1,2,3-benzotriazol-2-yl)-4-methylphenol is 240.10 g/mol.
Where can I buy 2-Amino-6-(2H-1,2,3-benzotriazol-2-yl)-4-methylphenol?
You can request a quote for 2-Amino-6-(2H-1,2,3-benzotriazol-2-yl)-4-methylphenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Amino-6-(2H-1,2,3-benzotriazol-2-yl)-4-methylphenol?
Yes, KEHONG BIO provides custom synthesis services for 2-Amino-6-(2H-1,2,3-benzotriazol-2-yl)-4-methylphenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.