2-Octyl-2H-benzo(d)(1,2,3)triazole
TL;DR: 2-Octyl-2H-benzo(d)(1,2,3)triazole (CAS 112642-69-0) is a chemical compound with molecular formula C14H21N3 and molecular weight 231.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-octylbenzotriazole
Also Known As: 2-octylbenzotriazole, 2-n-Octylbenzotriazole, 2-Octyl-2H-benzo[d][1,2,3]triazole, 2-Octyl-2H-benzotriazole, 2-octyl-2H-1,2,3-benzotriazole
| Molecular Formula | C14H21N3 |
|---|---|
| Molecular Weight | 231.17 g/mol |
| LogP | 3.7918 |
| Topological Polar Surface Area | 30.71 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 231.17355 |
| Heavy Atoms | 17 |
| Complexity | 414.41898 |
Chemical Identifiers
| CAS Number | 112642-69-0 |
|---|---|
| SMILES | CCCCCCCCN1N=C2C=CC=CC2=N1 |
Product Overview
2-Octyl-2H-benzo(d)(1,2,3)triazole (CAS 112642-69-0), with molecular formula C14H21N3 and molecular weight 231.17 g/mol. IUPAC: 2-octylbenzotriazole.
Chemical Property Profile of 2-Octyl-2H-benzo(d)(1,2,3)triazole
Property Insights of 2-Octyl-2H-benzo(d)(1,2,3)triazole
The XLogP value of 3.7918 indicates that 2-Octyl-2H-benzo(d)(1,2,3)triazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.71 Ų, 2-Octyl-2H-benzo(d)(1,2,3)triazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Octyl-2H-benzo(d)(1,2,3)triazole 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-Octyl-2H-benzo(d)(1,2,3)triazole?
The CAS number of 2-Octyl-2H-benzo(d)(1,2,3)triazole is 112642-69-0.
What is the molecular formula of 2-Octyl-2H-benzo(d)(1,2,3)triazole?
The molecular formula of 2-Octyl-2H-benzo(d)(1,2,3)triazole is C14H21N3.
What is the molecular weight of 2-Octyl-2H-benzo(d)(1,2,3)triazole?
The molecular weight of 2-Octyl-2H-benzo(d)(1,2,3)triazole is 231.17 g/mol.
Where can I buy 2-Octyl-2H-benzo(d)(1,2,3)triazole?
You can request a quote for 2-Octyl-2H-benzo(d)(1,2,3)triazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Octyl-2H-benzo(d)(1,2,3)triazole?
Yes, KEHONG BIO provides custom synthesis services for 2-Octyl-2H-benzo(d)(1,2,3)triazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.