2-Pentylbenzotriazole
TL;DR: 2-Pentylbenzotriazole (CAS 69218-27-5) is a chemical compound with molecular formula C11H15N3 and molecular weight 189.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-pentylbenzotriazole
Also Known As: 2-pentylbenzotriazole, 2-Pentyl-2H-benzotriazole, 2-pentyl-2H-1,2,3-benzotriazole, 2-pentyl-2H-benzo[d][1,2,3]triazole
| Molecular Formula | C11H15N3 |
|---|---|
| Molecular Weight | 189.13 g/mol |
| LogP | 2.6215 |
| Topological Polar Surface Area | 30.71 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 189.1266 |
| Heavy Atoms | 14 |
| Complexity | 372.57977 |
Chemical Identifiers
| CAS Number | 69218-27-5 |
|---|---|
| SMILES | CCCCCN1N=C2C=CC=CC2=N1 |
Product Overview
2-Pentylbenzotriazole (CAS 69218-27-5), with molecular formula C11H15N3 and molecular weight 189.13 g/mol. IUPAC: 2-pentylbenzotriazole.
Chemical Property Profile of 2-Pentylbenzotriazole
Property Insights of 2-Pentylbenzotriazole
The XLogP value of 2.6215 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Pentylbenzotriazole. With a topological polar surface area (TPSA) of 30.71 Ų, 2-Pentylbenzotriazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Pentylbenzotriazole has 0 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 2-Pentylbenzotriazole?
The CAS number of 2-Pentylbenzotriazole is 69218-27-5.
What is the molecular formula of 2-Pentylbenzotriazole?
The molecular formula of 2-Pentylbenzotriazole is C11H15N3.
What is the molecular weight of 2-Pentylbenzotriazole?
The molecular weight of 2-Pentylbenzotriazole is 189.13 g/mol.
Where can I buy 2-Pentylbenzotriazole?
You can request a quote for 2-Pentylbenzotriazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Pentylbenzotriazole?
Yes, KEHONG BIO provides custom synthesis services for 2-Pentylbenzotriazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.