Benzene, (1-methyldecyl)-
TL;DR: Benzene, (1-methyldecyl)- (CAS 4536-88-3) is a chemical compound with molecular formula C17H28 and molecular weight 232.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
undecan-2-ylbenzene
Also Known As: 2-PHENYLUNDECANE, Benzene, (1-methyldecyl)-, undecan-2-ylbenzene, Undecane, 2-phenyl-, 2-phe-nylundecane
| Molecular Formula | C17H28 |
|---|---|
| Molecular Weight | 232.22 g/mol |
| LogP | 7.4 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 9 |
| Exact Mass | 232.2191 |
| Heavy Atoms | 17 |
| Complexity | 155.0 |
| Vapor Pressure | 0.00155 [mmHg] |
Chemical Identifiers
| CAS Number | 4536-88-3 |
|---|---|
| SMILES | CCCCCCCCCC(C)C1=CC=CC=C1 |
| InChIKey | YHJBCRBYDBNEIK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzene, (1-methyldecyl)- (CAS 4536-88-3), with molecular formula C17H28 and molecular weight 232.22 g/mol. IUPAC: undecan-2-ylbenzene.
Chemical Property Profile of Benzene, (1-methyldecyl)-
Property Insights of Benzene, (1-methyldecyl)-
The XLogP value of 7.4 indicates that Benzene, (1-methyldecyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Benzene, (1-methyldecyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, (1-methyldecyl)- 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 Benzene, (1-methyldecyl)-?
The CAS number of Benzene, (1-methyldecyl)- is 4536-88-3.
What is the molecular formula of Benzene, (1-methyldecyl)-?
The molecular formula of Benzene, (1-methyldecyl)- is C17H28.
What is the molecular weight of Benzene, (1-methyldecyl)-?
The molecular weight of Benzene, (1-methyldecyl)- is 232.22 g/mol.
Where can I buy Benzene, (1-methyldecyl)-?
You can request a quote for Benzene, (1-methyldecyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, (1-methyldecyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, (1-methyldecyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.