Tri-m-xylylene
TL;DR: Tri-m-xylylene (CAS 13612-55-0) is a chemical compound with molecular formula C24H24 and molecular weight 312.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tetracyclo[16.3.1.14,8.111,15]tetracosa-1(22),4(24),5,7,11,13,15(23),18,20-nonaene
Also Known As: Tri-m-xylylene, [2.2.2]Metacyclophane, <2.2.2>metacyclophane, <2.2.2>-Metacyclophan, 1,4,7(1,3)-Tribenzenacyclononaphane
| Molecular Formula | C24H24 |
|---|---|
| Molecular Weight | 312.19 g/mol |
| LogP | 6.6 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 312.1878 |
| Heavy Atoms | 24 |
| Complexity | 285.0 |
Chemical Identifiers
| CAS Number | 13612-55-0 |
|---|---|
| SMILES | C1CC2=CC(=CC=C2)CCC3=CC=CC(=C3)CCC4=CC=CC1=C4 |
| InChIKey | TZYSWQJEJIRCNE-UHFFFAOYSA-N |
Product Overview
Tri-m-xylylene (CAS 13612-55-0), with molecular formula C24H24 and molecular weight 312.19 g/mol. IUPAC: tetracyclo[16.3.1.14,8.111,15]tetracosa-1(22),4(24),5,7,11,13,15(23),18,20-nonaene.
Chemical Property Profile of Tri-m-xylylene
Property Insights of Tri-m-xylylene
The XLogP value of 6.6 indicates that Tri-m-xylylene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Tri-m-xylylene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tri-m-xylylene has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Tri-m-xylylene?
The CAS number of Tri-m-xylylene is 13612-55-0.
What is the molecular formula of Tri-m-xylylene?
The molecular formula of Tri-m-xylylene is C24H24.
What is the molecular weight of Tri-m-xylylene?
The molecular weight of Tri-m-xylylene is 312.19 g/mol.
Where can I buy Tri-m-xylylene?
You can request a quote for Tri-m-xylylene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tri-m-xylylene?
Yes, KEHONG BIO provides custom synthesis services for Tri-m-xylylene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.