1H-Benzotriazole, 1-ethenyl-
TL;DR: 1H-Benzotriazole, 1-ethenyl- (CAS 2764-84-3) is a chemical compound with molecular formula C8H7N3 and molecular weight 145.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethenylbenzotriazole
Also Known As: 1-ethenylbenzotriazole, 1-Vinyl-1H-benzo[d][1,2,3]triazole, 1H-Benzotriazole, 1-ethenyl-, 1-Vinylbenzotriazole, n-vinylbenzotriazole
| Molecular Formula | C8H7N3 |
|---|---|
| Molecular Weight | 145.06 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 30.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 145.064 |
| Heavy Atoms | 11 |
| Complexity | 157.0 |
Chemical Identifiers
| CAS Number | 2764-84-3 |
|---|---|
| SMILES | C=CN1C2=CC=CC=C2N=N1 |
| InChIKey | OKHGMSQINQQCIE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1H-Benzotriazole, 1-ethenyl- (CAS 2764-84-3), with molecular formula C8H7N3 and molecular weight 145.06 g/mol. IUPAC: 1-ethenylbenzotriazole.
Chemical Property Profile of 1H-Benzotriazole, 1-ethenyl-
Property Insights of 1H-Benzotriazole, 1-ethenyl-
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Benzotriazole, 1-ethenyl-. With a topological polar surface area (TPSA) of 30.7 Ų, 1H-Benzotriazole, 1-ethenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Benzotriazole, 1-ethenyl- 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 1H-Benzotriazole, 1-ethenyl-?
The CAS number of 1H-Benzotriazole, 1-ethenyl- is 2764-84-3.
What is the molecular formula of 1H-Benzotriazole, 1-ethenyl-?
The molecular formula of 1H-Benzotriazole, 1-ethenyl- is C8H7N3.
What is the molecular weight of 1H-Benzotriazole, 1-ethenyl-?
The molecular weight of 1H-Benzotriazole, 1-ethenyl- is 145.06 g/mol.
Where can I buy 1H-Benzotriazole, 1-ethenyl-?
You can request a quote for 1H-Benzotriazole, 1-ethenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Benzotriazole, 1-ethenyl-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Benzotriazole, 1-ethenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.