5-Chloro-1-(cyclohexyloxy)-1H-benzotriazole
TL;DR: 5-Chloro-1-(cyclohexyloxy)-1H-benzotriazole (CAS 68230-01-3) is a chemical compound with molecular formula C12H14ClN3O and molecular weight 251.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-1-cyclohexyloxybenzotriazole
Also Known As: 5-chloro-1-cyclohexyloxybenzotriazole, 5-Chloro-1-(cyclohexyloxy)-1H-benzotriazole, 5-Chloro-1-(cyclohexyloxy)-1H-1,2,3-benzotriazole
| Molecular Formula | C12H14ClN3O |
|---|---|
| Molecular Weight | 251.08 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 39.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 251.08253 |
| Heavy Atoms | 17 |
| Complexity | 260.0 |
Chemical Identifiers
| CAS Number | 68230-01-3 |
|---|---|
| SMILES | C1CCC(CC1)ON2C3=C(C=C(C=C3)Cl)N=N2 |
| InChIKey | YTVQAEMUPKHUCI-UHFFFAOYSA-N |
Product Overview
5-Chloro-1-(cyclohexyloxy)-1H-benzotriazole (CAS 68230-01-3), with molecular formula C12H14ClN3O and molecular weight 251.08 g/mol. IUPAC: 5-chloro-1-cyclohexyloxybenzotriazole.
Chemical Property Profile of 5-Chloro-1-(cyclohexyloxy)-1H-benzotriazole
Property Insights of 5-Chloro-1-(cyclohexyloxy)-1H-benzotriazole
The XLogP value of 4.0 indicates that 5-Chloro-1-(cyclohexyloxy)-1H-benzotriazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.9 Ų, 5-Chloro-1-(cyclohexyloxy)-1H-benzotriazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Chloro-1-(cyclohexyloxy)-1H-benzotriazole has 0 hydrogen bond donor(s) and 3 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 5-Chloro-1-(cyclohexyloxy)-1H-benzotriazole?
The CAS number of 5-Chloro-1-(cyclohexyloxy)-1H-benzotriazole is 68230-01-3.
What is the molecular formula of 5-Chloro-1-(cyclohexyloxy)-1H-benzotriazole?
The molecular formula of 5-Chloro-1-(cyclohexyloxy)-1H-benzotriazole is C12H14ClN3O.
What is the molecular weight of 5-Chloro-1-(cyclohexyloxy)-1H-benzotriazole?
The molecular weight of 5-Chloro-1-(cyclohexyloxy)-1H-benzotriazole is 251.08 g/mol.
Where can I buy 5-Chloro-1-(cyclohexyloxy)-1H-benzotriazole?
You can request a quote for 5-Chloro-1-(cyclohexyloxy)-1H-benzotriazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Chloro-1-(cyclohexyloxy)-1H-benzotriazole?
Yes, KEHONG BIO provides custom synthesis services for 5-Chloro-1-(cyclohexyloxy)-1H-benzotriazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.