1-Butyl-1H-benzotriazole
TL;DR: 1-Butyl-1H-benzotriazole (CAS 708-43-0) is a chemical compound with molecular formula C10H13N3 and molecular weight 175.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-butylbenzotriazole
Also Known As: 1-butylbenzotriazole, 1-Butyl-1H-benzo[d][1,2,3]triazole, 1-n-Butylbenzotriazole, 1-butyl-1H-benzotriazole, 1-Butyl benzotriazole
| Molecular Formula | C10H13N3 |
|---|---|
| Molecular Weight | 175.11 g/mol |
| LogP | 2.2314 |
| Topological Polar Surface Area | 30.71 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 175.11095 |
| Heavy Atoms | 13 |
| Complexity | 391.72412 |
Chemical Identifiers
| CAS Number | 708-43-0 |
|---|---|
| SMILES | CCCCN1C2=CC=CC=C2N=N1 |
Product Overview
1-Butyl-1H-benzotriazole (CAS 708-43-0), with molecular formula C10H13N3 and molecular weight 175.11 g/mol. IUPAC: 1-butylbenzotriazole.
Chemical Property Profile of 1-Butyl-1H-benzotriazole
Property Insights of 1-Butyl-1H-benzotriazole
The XLogP value of 2.2314 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Butyl-1H-benzotriazole. With a topological polar surface area (TPSA) of 30.71 Ų, 1-Butyl-1H-benzotriazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Butyl-1H-benzotriazole 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 1-Butyl-1H-benzotriazole?
The CAS number of 1-Butyl-1H-benzotriazole is 708-43-0.
What is the molecular formula of 1-Butyl-1H-benzotriazole?
The molecular formula of 1-Butyl-1H-benzotriazole is C10H13N3.
What is the molecular weight of 1-Butyl-1H-benzotriazole?
The molecular weight of 1-Butyl-1H-benzotriazole is 175.11 g/mol.
Where can I buy 1-Butyl-1H-benzotriazole?
You can request a quote for 1-Butyl-1H-benzotriazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Butyl-1H-benzotriazole?
Yes, KEHONG BIO provides custom synthesis services for 1-Butyl-1H-benzotriazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.