2-(2H-benzotriazol-2-yl)-5-(2,4,4-trimethylpentan-2-yl)phenol
TL;DR: 2-(2H-benzotriazol-2-yl)-5-(2,4,4-trimethylpentan-2-yl)phenol (CAS 58958-49-9) is a chemical compound with molecular formula C20H25N3O and molecular weight 323.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(benzotriazol-2-yl)-5-(2,4,4-trimethylpentan-2-yl)phenol
Also Known As: 2-(benzotriazol-2-yl)-5-(2,4,4-trimethylpentan-2-yl)phenol, 2-(2H-benzotriazol-2-yl)-5-(2,4,4-trimethylpentan-2-yl)phenol, 2-(2H-benzo[d][1,2,3]triazol-2-yl)-5-(2,4,4-trimethylpentan-2-yl)phenol
| Molecular Formula | C20H25N3O |
|---|---|
| Molecular Weight | 323.20 g/mol |
| LogP | 4.8399 |
| Topological Polar Surface Area | 50.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 323.19977 |
| Heavy Atoms | 24 |
| Complexity | 838.9665 |
Chemical Identifiers
| CAS Number | 58958-49-9 |
|---|---|
| SMILES | CC(C)(C)CC(C)(C)C1=CC(=C(C=C1)N2N=C3C=CC=CC3=N2)O |
Product Overview
2-(2H-benzotriazol-2-yl)-5-(2,4,4-trimethylpentan-2-yl)phenol (CAS 58958-49-9), with molecular formula C20H25N3O and molecular weight 323.20 g/mol. IUPAC: 2-(benzotriazol-2-yl)-5-(2,4,4-trimethylpentan-2-yl)phenol.
Chemical Property Profile of 2-(2H-benzotriazol-2-yl)-5-(2,4,4-trimethylpentan-2-yl)phenol
Property Insights of 2-(2H-benzotriazol-2-yl)-5-(2,4,4-trimethylpentan-2-yl)phenol
The XLogP value of 4.8399 indicates that 2-(2H-benzotriazol-2-yl)-5-(2,4,4-trimethylpentan-2-yl)phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.94 Ų, 2-(2H-benzotriazol-2-yl)-5-(2,4,4-trimethylpentan-2-yl)phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2H-benzotriazol-2-yl)-5-(2,4,4-trimethylpentan-2-yl)phenol has 1 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-(2H-benzotriazol-2-yl)-5-(2,4,4-trimethylpentan-2-yl)phenol?
The CAS number of 2-(2H-benzotriazol-2-yl)-5-(2,4,4-trimethylpentan-2-yl)phenol is 58958-49-9.
What is the molecular formula of 2-(2H-benzotriazol-2-yl)-5-(2,4,4-trimethylpentan-2-yl)phenol?
The molecular formula of 2-(2H-benzotriazol-2-yl)-5-(2,4,4-trimethylpentan-2-yl)phenol is C20H25N3O.
What is the molecular weight of 2-(2H-benzotriazol-2-yl)-5-(2,4,4-trimethylpentan-2-yl)phenol?
The molecular weight of 2-(2H-benzotriazol-2-yl)-5-(2,4,4-trimethylpentan-2-yl)phenol is 323.20 g/mol.
Where can I buy 2-(2H-benzotriazol-2-yl)-5-(2,4,4-trimethylpentan-2-yl)phenol?
You can request a quote for 2-(2H-benzotriazol-2-yl)-5-(2,4,4-trimethylpentan-2-yl)phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2H-benzotriazol-2-yl)-5-(2,4,4-trimethylpentan-2-yl)phenol?
Yes, KEHONG BIO provides custom synthesis services for 2-(2H-benzotriazol-2-yl)-5-(2,4,4-trimethylpentan-2-yl)phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.