1,2,4-三唑
TL;DR: 1,2,4-三唑 (CAS 288-88-0) is a chemical compound with molecular formula C2H3N3 and molecular weight 69.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,4-三唑
1H-1,2,4-triazole
Also Known As: 1H-1,2,4-Triazole, 1,2,4-TRIAZOLE, 4H-1,2,4-triazole, Pyrrodiazole, s-Triazole
| Molecular Formula | C2H3N3 |
|---|---|
| Molecular Weight | 69.03 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 41.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 69.0327 |
| Heavy Atoms | 5 |
| Complexity | 28.0 |
| Melting Point | 120-121 °C |
| Boiling Point | 260 °C (decomposes) |
| Density | 640 kg/m³ |
| Solubility | Soluble in water, ethanol |
| Flash Point | 170 °C closed cup |
| Vapor Pressure | 0.6 [mmHg] |
Chemical Identifiers
| CAS Number | 288-88-0 |
|---|---|
| SMILES | C1=NC=NN1 |
| InChIKey | NSPMIYGKQJPBQR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2,4-三唑 (CAS 288-88-0), with molecular formula C2H3N3 and molecular weight 69.03 g/mol. IUPAC: 1H-1,2,4-triazole.
Chemical Property Profile of 1,2,4-三唑
Property Insights of 1,2,4-三唑
The XLogP value of -0.6 indicates that 1,2,4-三唑 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 41.6 Ų, 1,2,4-三唑 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,4-三唑 has 1 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 1,2,4-三唑?
The CAS number of 1,2,4-三唑 is 288-88-0.
What is the molecular formula of 1,2,4-三唑?
The molecular formula of 1,2,4-三唑 is C2H3N3.
What is the molecular weight of 1,2,4-三唑?
The molecular weight of 1,2,4-三唑 is 69.03 g/mol.
Where can I buy 1,2,4-三唑?
You can request a quote for 1,2,4-三唑 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,4-三唑?
Yes, KEHONG BIO provides custom synthesis services for 1,2,4-三唑 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.