1,3,5-Tris(chloroethyl)benzene
TL;DR: 1,3,5-Tris(chloroethyl)benzene (CAS 18226-46-5) is a chemical compound with molecular formula C12H15Cl3 and molecular weight 264.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,5-tris(2-chloroethyl)benzene
Also Known As: 1,3,5-tris(2-chloroethyl)benzene, 1,3,5-TRIS(CHLOROETHYL)BENZENE, A',, A''-Tribromomesitylene, 1,3,5-tris(2-chloroethyl)-benzene
| Molecular Formula | C12H15Cl3 |
|---|---|
| Molecular Weight | 264.02 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 6 |
| Exact Mass | 264.02393 |
| Heavy Atoms | 15 |
| Complexity | 120.0 |
Chemical Identifiers
| CAS Number | 18226-46-5 |
|---|---|
| SMILES | C1=C(C=C(C=C1CCCl)CCCl)CCCl |
| InChIKey | SQGGRXLKGOLABD-UHFFFAOYSA-N |
Product Overview
1,3,5-Tris(chloroethyl)benzene (CAS 18226-46-5), with molecular formula C12H15Cl3 and molecular weight 264.02 g/mol. IUPAC: 1,3,5-tris(2-chloroethyl)benzene.
Chemical Property Profile of 1,3,5-Tris(chloroethyl)benzene
Property Insights of 1,3,5-Tris(chloroethyl)benzene
The XLogP value of 4.5 indicates that 1,3,5-Tris(chloroethyl)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,3,5-Tris(chloroethyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3,5-Tris(chloroethyl)benzene has 0 hydrogen bond donor(s) and 0 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 1,3,5-Tris(chloroethyl)benzene?
The CAS number of 1,3,5-Tris(chloroethyl)benzene is 18226-46-5.
What is the molecular formula of 1,3,5-Tris(chloroethyl)benzene?
The molecular formula of 1,3,5-Tris(chloroethyl)benzene is C12H15Cl3.
What is the molecular weight of 1,3,5-Tris(chloroethyl)benzene?
The molecular weight of 1,3,5-Tris(chloroethyl)benzene is 264.02 g/mol.
Where can I buy 1,3,5-Tris(chloroethyl)benzene?
You can request a quote for 1,3,5-Tris(chloroethyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,5-Tris(chloroethyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1,3,5-Tris(chloroethyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.