7-methoxy-1H-1,2,3-benzotriazole
TL;DR: 7-methoxy-1H-1,2,3-benzotriazole (CAS 27799-90-2) is a chemical compound with molecular formula C7H7N3O and molecular weight 149.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxy-2H-benzotriazole
Also Known As: 4-Methoxy-1H-benzotriazole, 4-methoxy-2H-benzotriazole, 7-methoxy-1H-benzo[d][1,2,3]triazole, 1H-Benzotriazole, 7-methoxy-, (4-methoxy)benzotriazole
| Molecular Formula | C7H7N3O |
|---|---|
| Molecular Weight | 149.06 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 50.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 149.05891 |
| Heavy Atoms | 11 |
| Complexity | 142.0 |
Chemical Identifiers
| CAS Number | 27799-90-2 |
|---|---|
| SMILES | COC1=CC=CC2=NNN=C21 |
| InChIKey | BFBZLCUTOUZMLJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
7-methoxy-1H-1,2,3-benzotriazole (CAS 27799-90-2), with molecular formula C7H7N3O and molecular weight 149.06 g/mol. IUPAC: 4-methoxy-2H-benzotriazole.
Chemical Property Profile of 7-methoxy-1H-1,2,3-benzotriazole
Property Insights of 7-methoxy-1H-1,2,3-benzotriazole
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-methoxy-1H-1,2,3-benzotriazole. With a topological polar surface area (TPSA) of 50.8 Ų, 7-methoxy-1H-1,2,3-benzotriazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-methoxy-1H-1,2,3-benzotriazole has 1 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 7-methoxy-1H-1,2,3-benzotriazole?
The CAS number of 7-methoxy-1H-1,2,3-benzotriazole is 27799-90-2.
What is the molecular formula of 7-methoxy-1H-1,2,3-benzotriazole?
The molecular formula of 7-methoxy-1H-1,2,3-benzotriazole is C7H7N3O.
What is the molecular weight of 7-methoxy-1H-1,2,3-benzotriazole?
The molecular weight of 7-methoxy-1H-1,2,3-benzotriazole is 149.06 g/mol.
Where can I buy 7-methoxy-1H-1,2,3-benzotriazole?
You can request a quote for 7-methoxy-1H-1,2,3-benzotriazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-methoxy-1H-1,2,3-benzotriazole?
Yes, KEHONG BIO provides custom synthesis services for 7-methoxy-1H-1,2,3-benzotriazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.