1-Hexadecylbenzotriazole
TL;DR: 1-Hexadecylbenzotriazole (CAS 49636-58-0) is a chemical compound with molecular formula C22H37N3 and molecular weight 343.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-hexadecylbenzotriazole
Also Known As: 1-hexadecylbenzotriazole, 1-hexadecyl-1H-1,2,3-benzotriazole, AO-772/15524008
| Molecular Formula | C22H37N3 |
|---|---|
| Molecular Weight | 343.30 g/mol |
| LogP | 6.9126 |
| Topological Polar Surface Area | 30.71 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 15 |
| Exact Mass | 343.29874 |
| Heavy Atoms | 25 |
| Complexity | 561.1526 |
Chemical Identifiers
| CAS Number | 49636-58-0 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCN1C2=CC=CC=C2N=N1 |
Product Overview
1-Hexadecylbenzotriazole (CAS 49636-58-0), with molecular formula C22H37N3 and molecular weight 343.30 g/mol. IUPAC: 1-hexadecylbenzotriazole.
Chemical Property Profile of 1-Hexadecylbenzotriazole
Property Insights of 1-Hexadecylbenzotriazole
The XLogP value of 6.9126 indicates that 1-Hexadecylbenzotriazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.71 Ų, 1-Hexadecylbenzotriazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Hexadecylbenzotriazole has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Hexadecylbenzotriazole?
The CAS number of 1-Hexadecylbenzotriazole is 49636-58-0.
What is the molecular formula of 1-Hexadecylbenzotriazole?
The molecular formula of 1-Hexadecylbenzotriazole is C22H37N3.
What is the molecular weight of 1-Hexadecylbenzotriazole?
The molecular weight of 1-Hexadecylbenzotriazole is 343.30 g/mol.
Where can I buy 1-Hexadecylbenzotriazole?
You can request a quote for 1-Hexadecylbenzotriazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Hexadecylbenzotriazole?
Yes, KEHONG BIO provides custom synthesis services for 1-Hexadecylbenzotriazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.