4,4''-Dimethyl-5'-(4-methylphenyl)-1,1':3',1''-terphenyl
TL;DR: 4,4''-Dimethyl-5'-(4-methylphenyl)-1,1':3',1''-terphenyl (CAS 50446-43-0) is a chemical compound with molecular formula C27H24 and molecular weight 348.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,5-tris(4-methylphenyl)benzene
Also Known As: 1,3,5-Tris(4-methylphenyl)benzene, 4,4''-Dimethyl-5'-(p-tolyl)-1,1':3',1''-terphenyl, 1,3,5-Tri(p-tolyl)benzene, 1,3,5-tris(p-tolyl)benzene, 1,3,5-Tri(4-methylphenyl)benzene
| Molecular Formula | C27H24 |
|---|---|
| Molecular Weight | 348.19 g/mol |
| LogP | 7.9 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 3 |
| Exact Mass | 348.1878 |
| Heavy Atoms | 27 |
| Complexity | 350.0 |
Chemical Identifiers
| CAS Number | 50446-43-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=CC(=CC(=C2)C3=CC=C(C=C3)C)C4=CC=C(C=C4)C |
| InChIKey | XMGRUKCVUYLTKU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,4''-Dimethyl-5'-(4-methylphenyl)-1,1':3',1''-terphenyl (CAS 50446-43-0), with molecular formula C27H24 and molecular weight 348.19 g/mol. IUPAC: 1,3,5-tris(4-methylphenyl)benzene.
Chemical Property Profile of 4,4''-Dimethyl-5'-(4-methylphenyl)-1,1':3',1''-terphenyl
Property Insights of 4,4''-Dimethyl-5'-(4-methylphenyl)-1,1':3',1''-terphenyl
The XLogP value of 7.9 indicates that 4,4''-Dimethyl-5'-(4-methylphenyl)-1,1':3',1''-terphenyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 4,4''-Dimethyl-5'-(4-methylphenyl)-1,1':3',1''-terphenyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,4''-Dimethyl-5'-(4-methylphenyl)-1,1':3',1''-terphenyl 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 4,4''-Dimethyl-5'-(4-methylphenyl)-1,1':3',1''-terphenyl?
The CAS number of 4,4''-Dimethyl-5'-(4-methylphenyl)-1,1':3',1''-terphenyl is 50446-43-0.
What is the molecular formula of 4,4''-Dimethyl-5'-(4-methylphenyl)-1,1':3',1''-terphenyl?
The molecular formula of 4,4''-Dimethyl-5'-(4-methylphenyl)-1,1':3',1''-terphenyl is C27H24.
What is the molecular weight of 4,4''-Dimethyl-5'-(4-methylphenyl)-1,1':3',1''-terphenyl?
The molecular weight of 4,4''-Dimethyl-5'-(4-methylphenyl)-1,1':3',1''-terphenyl is 348.19 g/mol.
Where can I buy 4,4''-Dimethyl-5'-(4-methylphenyl)-1,1':3',1''-terphenyl?
You can request a quote for 4,4''-Dimethyl-5'-(4-methylphenyl)-1,1':3',1''-terphenyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4''-Dimethyl-5'-(4-methylphenyl)-1,1':3',1''-terphenyl?
Yes, KEHONG BIO provides custom synthesis services for 4,4''-Dimethyl-5'-(4-methylphenyl)-1,1':3',1''-terphenyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.