3,3'-Diethylbiphenyl
TL;DR: 3,3'-Diethylbiphenyl (CAS 13049-38-2) is a chemical compound with molecular formula C16H18 and molecular weight 210.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethyl-3-(3-ethylphenyl)benzene
Also Known As: 3,3'-Diethylbiphenyl, Diethylbiphenyl, 3,3'-Diethyl-1,1'-biphenyl, 1,1'-Biphenyl,3,3'-diethyl-, 1-ethyl-3-(3-ethylphenyl)benzene
| Molecular Formula | C16H18 |
|---|---|
| Molecular Weight | 210.14 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 3 |
| Exact Mass | 210.14085 |
| Heavy Atoms | 16 |
| Complexity | 174.0 |
Chemical Identifiers
| CAS Number | 13049-38-2 |
|---|---|
| SMILES | CCC1=CC(=CC=C1)C2=CC=CC(=C2)CC |
| InChIKey | RUNQGXYOXGYVOX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,3'-Diethylbiphenyl (CAS 13049-38-2), with molecular formula C16H18 and molecular weight 210.14 g/mol. IUPAC: 1-ethyl-3-(3-ethylphenyl)benzene.
Chemical Property Profile of 3,3'-Diethylbiphenyl
Property Insights of 3,3'-Diethylbiphenyl
The XLogP value of 5.1 indicates that 3,3'-Diethylbiphenyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 3,3'-Diethylbiphenyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3'-Diethylbiphenyl 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 3,3'-Diethylbiphenyl?
The CAS number of 3,3'-Diethylbiphenyl is 13049-38-2.
What is the molecular formula of 3,3'-Diethylbiphenyl?
The molecular formula of 3,3'-Diethylbiphenyl is C16H18.
What is the molecular weight of 3,3'-Diethylbiphenyl?
The molecular weight of 3,3'-Diethylbiphenyl is 210.14 g/mol.
Where can I buy 3,3'-Diethylbiphenyl?
You can request a quote for 3,3'-Diethylbiphenyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3'-Diethylbiphenyl?
Yes, KEHONG BIO provides custom synthesis services for 3,3'-Diethylbiphenyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.