1,3,5-Tributylbenzene
TL;DR: 1,3,5-Tributylbenzene (CAS 841-07-6) is a chemical compound with molecular formula C18H30 and molecular weight 246.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,5-tributylbenzene
Also Known As: 1,3,5-Tributylbenzene, Benzene, 1,3,5-tributyl-, 1,3,5-Tributyl-benzol, Benzene,1,3,5-tributyl-, RefChem:72331
| Molecular Formula | C18H30 |
|---|---|
| Molecular Weight | 246.23 g/mol |
| LogP | 7.6 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 9 |
| Exact Mass | 246.23476 |
| Heavy Atoms | 18 |
| Complexity | 139.0 |
Chemical Identifiers
| CAS Number | 841-07-6 |
|---|---|
| SMILES | CCCCC1=CC(=CC(=C1)CCCC)CCCC |
| InChIKey | AVYPEYYPGYMFDO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3,5-Tributylbenzene (CAS 841-07-6), with molecular formula C18H30 and molecular weight 246.23 g/mol. IUPAC: 1,3,5-tributylbenzene.
Chemical Property Profile of 1,3,5-Tributylbenzene
Property Insights of 1,3,5-Tributylbenzene
The XLogP value of 7.6 indicates that 1,3,5-Tributylbenzene 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-Tributylbenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3,5-Tributylbenzene 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 1,3,5-Tributylbenzene?
The CAS number of 1,3,5-Tributylbenzene is 841-07-6.
What is the molecular formula of 1,3,5-Tributylbenzene?
The molecular formula of 1,3,5-Tributylbenzene is C18H30.
What is the molecular weight of 1,3,5-Tributylbenzene?
The molecular weight of 1,3,5-Tributylbenzene is 246.23 g/mol.
Where can I buy 1,3,5-Tributylbenzene?
You can request a quote for 1,3,5-Tributylbenzene 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-Tributylbenzene?
Yes, KEHONG BIO provides custom synthesis services for 1,3,5-Tributylbenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.