1-Ethyltridecylbenzene
TL;DR: 1-Ethyltridecylbenzene (CAS 4534-65-0) is a chemical compound with molecular formula C21H36 and molecular weight 288.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pentadecan-3-ylbenzene
Also Known As: 1-Ethyltridecylbenzene, Pentadecane, 3-phenyl-, pentadecan-3-ylbenzene, (pentadecan-3-yl)benzene, (1-Ethyltridecyl)benzene #
| Molecular Formula | C21H36 |
|---|---|
| Molecular Weight | 288.28 g/mol |
| LogP | 9.5 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 13 |
| Exact Mass | 288.2817 |
| Heavy Atoms | 21 |
| Complexity | 202.0 |
Chemical Identifiers
| CAS Number | 4534-65-0 |
|---|---|
| SMILES | CCCCCCCCCCCCC(CC)C1=CC=CC=C1 |
| InChIKey | PFONJKGJXKLBLH-UHFFFAOYSA-N |
Product Overview
1-Ethyltridecylbenzene (CAS 4534-65-0), with molecular formula C21H36 and molecular weight 288.28 g/mol. IUPAC: pentadecan-3-ylbenzene.
Chemical Property Profile of 1-Ethyltridecylbenzene
Property Insights of 1-Ethyltridecylbenzene
The XLogP value of 9.5 indicates that 1-Ethyltridecylbenzene 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-Ethyltridecylbenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Ethyltridecylbenzene 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-Ethyltridecylbenzene?
The CAS number of 1-Ethyltridecylbenzene is 4534-65-0.
What is the molecular formula of 1-Ethyltridecylbenzene?
The molecular formula of 1-Ethyltridecylbenzene is C21H36.
What is the molecular weight of 1-Ethyltridecylbenzene?
The molecular weight of 1-Ethyltridecylbenzene is 288.28 g/mol.
Where can I buy 1-Ethyltridecylbenzene?
You can request a quote for 1-Ethyltridecylbenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Ethyltridecylbenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Ethyltridecylbenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.