Dibenzylethylbenzene
TL;DR: Dibenzylethylbenzene (CAS 42504-55-2) is a chemical compound with molecular formula C22H22 and molecular weight 286.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2-dibenzyl-3-ethylbenzene
Also Known As: Dibenzylethylbenzene, dibenzyl ethyl benzene, 1,2-dibenzyl-3-ethyl-benzene, 1,2-dibenzyl-3-ethylbenzene, 1,1'-[(3-Ethyl-1,2-phenylene)bis(methylene)]dibenzene
| Molecular Formula | C22H22 |
|---|---|
| Molecular Weight | 286.17 g/mol |
| LogP | 6.6 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 5 |
| Exact Mass | 286.17215 |
| Heavy Atoms | 22 |
| Complexity | 295.0 |
Chemical Identifiers
| CAS Number | 42504-55-2 |
|---|---|
| SMILES | CCC1=C(C(=CC=C1)CC2=CC=CC=C2)CC3=CC=CC=C3 |
| InChIKey | WBQIISMZRBZAHJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dibenzylethylbenzene (CAS 42504-55-2), with molecular formula C22H22 and molecular weight 286.17 g/mol. IUPAC: 1,2-dibenzyl-3-ethylbenzene.
Chemical Property Profile of Dibenzylethylbenzene
Property Insights of Dibenzylethylbenzene
The XLogP value of 6.6 indicates that Dibenzylethylbenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Dibenzylethylbenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dibenzylethylbenzene 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 Dibenzylethylbenzene?
The CAS number of Dibenzylethylbenzene is 42504-55-2.
What is the molecular formula of Dibenzylethylbenzene?
The molecular formula of Dibenzylethylbenzene is C22H22.
What is the molecular weight of Dibenzylethylbenzene?
The molecular weight of Dibenzylethylbenzene is 286.17 g/mol.
Where can I buy Dibenzylethylbenzene?
You can request a quote for Dibenzylethylbenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dibenzylethylbenzene?
Yes, KEHONG BIO provides custom synthesis services for Dibenzylethylbenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.