2-(4-Methoxyphenyl)benzotriazole
TL;DR: 2-(4-Methoxyphenyl)benzotriazole (CAS 3933-76-4) is a chemical compound with molecular formula C13H11N3O and molecular weight 225.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methoxyphenyl)benzotriazole
Also Known As: 2-(4-methoxyphenyl)benzotriazole, 2-(4-methoxyphenyl)-2H-benzotriazole, J1.786.847K, 2-(4-methoxyphenyl)-2H-1,2,3-benzotriazole, 2-(4-hydroxyphenyl)-2h-benzotriazole, me ether
| Molecular Formula | C13H11N3O |
|---|---|
| Molecular Weight | 225.09 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 39.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 225.09021 |
| Heavy Atoms | 17 |
| Complexity | 239.0 |
Chemical Identifiers
| CAS Number | 3933-76-4 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2N=C3C=CC=CC3=N2 |
| InChIKey | NIRODTDWIZYNHE-UHFFFAOYSA-N |
Product Overview
2-(4-Methoxyphenyl)benzotriazole (CAS 3933-76-4), with molecular formula C13H11N3O and molecular weight 225.09 g/mol. IUPAC: 2-(4-methoxyphenyl)benzotriazole.
Chemical Property Profile of 2-(4-Methoxyphenyl)benzotriazole
Property Insights of 2-(4-Methoxyphenyl)benzotriazole
The XLogP value of 3.3 indicates that 2-(4-Methoxyphenyl)benzotriazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.9 Ų, 2-(4-Methoxyphenyl)benzotriazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Methoxyphenyl)benzotriazole has 0 hydrogen bond donor(s) and 3 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-(4-Methoxyphenyl)benzotriazole?
The CAS number of 2-(4-Methoxyphenyl)benzotriazole is 3933-76-4.
What is the molecular formula of 2-(4-Methoxyphenyl)benzotriazole?
The molecular formula of 2-(4-Methoxyphenyl)benzotriazole is C13H11N3O.
What is the molecular weight of 2-(4-Methoxyphenyl)benzotriazole?
The molecular weight of 2-(4-Methoxyphenyl)benzotriazole is 225.09 g/mol.
Where can I buy 2-(4-Methoxyphenyl)benzotriazole?
You can request a quote for 2-(4-Methoxyphenyl)benzotriazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Methoxyphenyl)benzotriazole?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Methoxyphenyl)benzotriazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.