2-Chloro-4,6-bis(chloromethyl)-1,3,5-triazine
TL;DR: 2-Chloro-4,6-bis(chloromethyl)-1,3,5-triazine (CAS 30894-87-2) is a chemical compound with molecular formula C5H4Cl3N3 and molecular weight 210.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-4,6-bis(chloromethyl)-1,3,5-triazine
Also Known As: 2-chloro-4,6-bis(chloromethyl)-1,3,5-triazine, J1.615.855K, 1,3,5-Triazine, 2-chloro-4,6-bis(chloromethyl)-, 2-CHLORO-4,6-BIS(CHLOROMETHYL)-S-TRIAZINE
| Molecular Formula | C5H4Cl3N3 |
|---|---|
| Molecular Weight | 210.95 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 38.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 210.94708 |
| Heavy Atoms | 11 |
| Complexity | 112.0 |
Chemical Identifiers
| CAS Number | 30894-87-2 |
|---|---|
| SMILES | C(C1=NC(=NC(=N1)Cl)CCl)Cl |
| InChIKey | YFRPWEWPYYRSTP-UHFFFAOYSA-N |
Product Overview
2-Chloro-4,6-bis(chloromethyl)-1,3,5-triazine (CAS 30894-87-2), with molecular formula C5H4Cl3N3 and molecular weight 210.95 g/mol. IUPAC: 2-chloro-4,6-bis(chloromethyl)-1,3,5-triazine.
Chemical Property Profile of 2-Chloro-4,6-bis(chloromethyl)-1,3,5-triazine
Property Insights of 2-Chloro-4,6-bis(chloromethyl)-1,3,5-triazine
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloro-4,6-bis(chloromethyl)-1,3,5-triazine. With a topological polar surface area (TPSA) of 38.7 Ų, 2-Chloro-4,6-bis(chloromethyl)-1,3,5-triazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-4,6-bis(chloromethyl)-1,3,5-triazine 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 2-Chloro-4,6-bis(chloromethyl)-1,3,5-triazine?
The CAS number of 2-Chloro-4,6-bis(chloromethyl)-1,3,5-triazine is 30894-87-2.
What is the molecular formula of 2-Chloro-4,6-bis(chloromethyl)-1,3,5-triazine?
The molecular formula of 2-Chloro-4,6-bis(chloromethyl)-1,3,5-triazine is C5H4Cl3N3.
What is the molecular weight of 2-Chloro-4,6-bis(chloromethyl)-1,3,5-triazine?
The molecular weight of 2-Chloro-4,6-bis(chloromethyl)-1,3,5-triazine is 210.95 g/mol.
Where can I buy 2-Chloro-4,6-bis(chloromethyl)-1,3,5-triazine?
You can request a quote for 2-Chloro-4,6-bis(chloromethyl)-1,3,5-triazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-4,6-bis(chloromethyl)-1,3,5-triazine?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-4,6-bis(chloromethyl)-1,3,5-triazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.