1-Hex-1-en-2-ylbenzotriazole
TL;DR: 1-Hex-1-en-2-ylbenzotriazole (CAS 142321-29-7) is a chemical compound with molecular formula C12H15N3 and molecular weight 201.1266 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-hex-1-en-2-ylbenzotriazole
Also Known As: 1-hex-1-en-2-ylbenzotriazole, 1-(hex-1-en-2-yl)-1H-benzo[d][1,2,3]triazole
Technical Specifications
| Molecular Formula | C12H15N3 |
| Molecular Weight | 201.1266 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 30.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 201.1266 Da |
| Heavy Atoms | 15 |
| Complexity | 227.0 |
| SMILES | CCCCC(=C)N1C2=CC=CC=C2N=N1 |
| InChIKey | PFLCJXSMPCXZIN-UHFFFAOYSA-N |
Chemical Property Profile of 1-Hex-1-en-2-ylbenzotriazole
Property Insights of 1-Hex-1-en-2-ylbenzotriazole
The XLogP value of 3.4 indicates that 1-Hex-1-en-2-ylbenzotriazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.7 Ų, 1-Hex-1-en-2-ylbenzotriazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Hex-1-en-2-ylbenzotriazole 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
What is the CAS number of 1-Hex-1-en-2-ylbenzotriazole?
The CAS number of 1-Hex-1-en-2-ylbenzotriazole is 142321-29-7.
What is the molecular formula of 1-Hex-1-en-2-ylbenzotriazole?
The molecular formula of 1-Hex-1-en-2-ylbenzotriazole is C12H15N3.
What is the molecular weight of 1-Hex-1-en-2-ylbenzotriazole?
The molecular weight of 1-Hex-1-en-2-ylbenzotriazole is 201.1266 g/mol.
Where can I buy 1-Hex-1-en-2-ylbenzotriazole?
You can request a quote for 1-Hex-1-en-2-ylbenzotriazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Hex-1-en-2-ylbenzotriazole?
Yes, CoreyChem provides custom synthesis services for 1-Hex-1-en-2-ylbenzotriazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.