(2-Methyloctyl)benzene
TL;DR: (2-Methyloctyl)benzene (CAS 49826-80-4) is a chemical compound with molecular formula C15H24 and molecular weight 204.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyloctylbenzene
Also Known As: 2-Benzyloctane, (2-Methyloctyl)benzene, 2-methyloctylbenzene, Benzene, (2-methyloctyl)-, (2-Methyloctyl)benzene #
| Molecular Formula | C15H24 |
|---|---|
| Molecular Weight | 204.19 g/mol |
| LogP | 6.2 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 7 |
| Exact Mass | 204.1878 |
| Heavy Atoms | 15 |
| Complexity | 133.0 |
Chemical Identifiers
| CAS Number | 49826-80-4 |
|---|---|
| SMILES | CCCCCCC(C)CC1=CC=CC=C1 |
| InChIKey | LNCYHRXIFYLQPO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(2-Methyloctyl)benzene (CAS 49826-80-4), with molecular formula C15H24 and molecular weight 204.19 g/mol. IUPAC: 2-methyloctylbenzene.
Chemical Property Profile of (2-Methyloctyl)benzene
Property Insights of (2-Methyloctyl)benzene
The XLogP value of 6.2 indicates that (2-Methyloctyl)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, (2-Methyloctyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2-Methyloctyl)benzene 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 (2-Methyloctyl)benzene?
The CAS number of (2-Methyloctyl)benzene is 49826-80-4.
What is the molecular formula of (2-Methyloctyl)benzene?
The molecular formula of (2-Methyloctyl)benzene is C15H24.
What is the molecular weight of (2-Methyloctyl)benzene?
The molecular weight of (2-Methyloctyl)benzene is 204.19 g/mol.
Where can I buy (2-Methyloctyl)benzene?
You can request a quote for (2-Methyloctyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Methyloctyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for (2-Methyloctyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.