3-Ethyl-2,7-dimethyloctane
TL;DR: 3-Ethyl-2,7-dimethyloctane (CAS 62183-55-5) is a chemical compound with molecular formula C12H26 and molecular weight 170.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethyl-2,7-dimethyloctane
Also Known As: 3-Ethyl-2,7-dimethyloctane, Octane, 3-ethyl-2,7-dimethyl-, 3-ethyl-2,7-dimethyl octane, 3-Ethyl-2,7-dimethyloctane #, RefChem:911308
| Molecular Formula | C12H26 |
|---|---|
| Molecular Weight | 170.20 g/mol |
| LogP | 5.8 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 6 |
| Exact Mass | 170.20345 |
| Heavy Atoms | 12 |
| Complexity | 92.0 |
Chemical Identifiers
| CAS Number | 62183-55-5 |
|---|---|
| SMILES | CCC(CCCC(C)C)C(C)C |
| InChIKey | XEMFRSYZKNPRTA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Ethyl-2,7-dimethyloctane (CAS 62183-55-5), with molecular formula C12H26 and molecular weight 170.20 g/mol. IUPAC: 3-ethyl-2,7-dimethyloctane.
Chemical Property Profile of 3-Ethyl-2,7-dimethyloctane
Property Insights of 3-Ethyl-2,7-dimethyloctane
The XLogP value of 5.8 indicates that 3-Ethyl-2,7-dimethyloctane 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-Ethyl-2,7-dimethyloctane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Ethyl-2,7-dimethyloctane 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-Ethyl-2,7-dimethyloctane?
The CAS number of 3-Ethyl-2,7-dimethyloctane is 62183-55-5.
What is the molecular formula of 3-Ethyl-2,7-dimethyloctane?
The molecular formula of 3-Ethyl-2,7-dimethyloctane is C12H26.
What is the molecular weight of 3-Ethyl-2,7-dimethyloctane?
The molecular weight of 3-Ethyl-2,7-dimethyloctane is 170.20 g/mol.
Where can I buy 3-Ethyl-2,7-dimethyloctane?
You can request a quote for 3-Ethyl-2,7-dimethyloctane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Ethyl-2,7-dimethyloctane?
Yes, KEHONG BIO provides custom synthesis services for 3-Ethyl-2,7-dimethyloctane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.