4-(Benzotriazol-2-yl)phenol
TL;DR: 4-(Benzotriazol-2-yl)phenol (CAS 3682-83-5) is a chemical compound with molecular formula C12H9N3O and molecular weight 211.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(benzotriazol-2-yl)phenol
Also Known As: 4-(benzotriazol-2-yl)phenol, 4-benzotriazol-2-ylphenol, 2-(4'-hydroxyphenyl)-benzotriazole, p-(2H-benzotriazol-2-yl)phenol, 2-(4-Hydroxyphenyl)-2H-benzotriazole
| Molecular Formula | C12H9N3O |
|---|---|
| Molecular Weight | 211.07 g/mol |
| LogP | 2.1261 |
| Topological Polar Surface Area | 50.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 211.07455 |
| Heavy Atoms | 16 |
| Complexity | 595.06384 |
Chemical Identifiers
| CAS Number | 3682-83-5 |
|---|---|
| SMILES | C1=CC2=NN(N=C2C=C1)C3=CC=C(C=C3)O |
Product Overview
4-(Benzotriazol-2-yl)phenol (CAS 3682-83-5), with molecular formula C12H9N3O and molecular weight 211.07 g/mol. IUPAC: 4-(benzotriazol-2-yl)phenol.
Chemical Property Profile of 4-(Benzotriazol-2-yl)phenol
Property Insights of 4-(Benzotriazol-2-yl)phenol
The XLogP value of 2.1261 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Benzotriazol-2-yl)phenol. With a topological polar surface area (TPSA) of 50.94 Ų, 4-(Benzotriazol-2-yl)phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Benzotriazol-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 4-(Benzotriazol-2-yl)phenol?
The CAS number of 4-(Benzotriazol-2-yl)phenol is 3682-83-5.
What is the molecular formula of 4-(Benzotriazol-2-yl)phenol?
The molecular formula of 4-(Benzotriazol-2-yl)phenol is C12H9N3O.
What is the molecular weight of 4-(Benzotriazol-2-yl)phenol?
The molecular weight of 4-(Benzotriazol-2-yl)phenol is 211.07 g/mol.
Where can I buy 4-(Benzotriazol-2-yl)phenol?
You can request a quote for 4-(Benzotriazol-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 4-(Benzotriazol-2-yl)phenol?
Yes, KEHONG BIO provides custom synthesis services for 4-(Benzotriazol-2-yl)phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.