三聚氰氯
TL;DR: 三聚氰氯 (CAS 108-77-0) is a chemical compound with molecular formula C3Cl3N3 and molecular weight 182.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
三聚氰氯
2,4,6-trichloro-1,3,5-triazine
Also Known As: Cyanuric chloride, Cyanuryl chloride, 2,4,6-Trichloro-1,3,5-triazine, Cyanuric acid chloride, Chlorotriazine
| Molecular Formula | C3Cl3N3 |
|---|---|
| Molecular Weight | 182.92 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 38.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 182.91579 |
| Heavy Atoms | 9 |
| Complexity | 69.0 |
| Melting Point | 146 °C |
| Boiling Point | 192 °C |
| Density | 1.32 at 20 °C |
| Solubility | Insol in water; sol in alcohol |
| Vapor Pressure | 0.02 [mmHg] |
Chemical Identifiers
| CAS Number | 108-77-0 |
|---|---|
| SMILES | C1(=NC(=NC(=N1)Cl)Cl)Cl |
| InChIKey | MGNCLNQXLYJVJD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
三聚氰氯 (CAS 108-77-0), with molecular formula C3Cl3N3 and molecular weight 182.92 g/mol. IUPAC: 2,4,6-trichloro-1,3,5-triazine.
Chemical Property Profile of 三聚氰氯
Property Insights of 三聚氰氯
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 三聚氰氯. With a topological polar surface area (TPSA) of 38.7 Ų, 三聚氰氯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 三聚氰氯 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 三聚氰氯?
The CAS number of 三聚氰氯 is 108-77-0.
What is the molecular formula of 三聚氰氯?
The molecular formula of 三聚氰氯 is C3Cl3N3.
What is the molecular weight of 三聚氰氯?
The molecular weight of 三聚氰氯 is 182.92 g/mol.
Where can I buy 三聚氰氯?
You can request a quote for 三聚氰氯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 三聚氰氯?
Yes, KEHONG BIO provides custom synthesis services for 三聚氰氯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.