3-Ethyl-2,2,4-trimethylpentane
TL;DR: 3-Ethyl-2,2,4-trimethylpentane (CAS 52897-18-4) is a chemical compound with molecular formula C10H22 and molecular weight 142.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethyl-2,2,4-trimethylpentane
Also Known As: 3-Ethyl-2,2,4-trimethylpentane, Pentane, 3-ethyl-2,2,4-trimethyl-, Pentane, 3-ethyl-2,2,4-trimethyl, 2,2,4-Trimethyl-3-ethylpentane, Pentane,3-ethyl-2,2,4-trimethyl
| Molecular Formula | C10H22 |
|---|---|
| Molecular Weight | 142.17 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 3 |
| Exact Mass | 142.17215 |
| Heavy Atoms | 10 |
| Complexity | 84.0 |
Chemical Identifiers
| CAS Number | 52897-18-4 |
|---|---|
| SMILES | CCC(C(C)C)C(C)(C)C |
| InChIKey | VLIZIVHXZXQRDE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Ethyl-2,2,4-trimethylpentane (CAS 52897-18-4), with molecular formula C10H22 and molecular weight 142.17 g/mol. IUPAC: 3-ethyl-2,2,4-trimethylpentane.
Chemical Property Profile of 3-Ethyl-2,2,4-trimethylpentane
Property Insights of 3-Ethyl-2,2,4-trimethylpentane
The XLogP value of 4.6 indicates that 3-Ethyl-2,2,4-trimethylpentane 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-2,2,4-trimethylpentane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Ethyl-2,2,4-trimethylpentane has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-Ethyl-2,2,4-trimethylpentane?
The CAS number of 3-Ethyl-2,2,4-trimethylpentane is 52897-18-4.
What is the molecular formula of 3-Ethyl-2,2,4-trimethylpentane?
The molecular formula of 3-Ethyl-2,2,4-trimethylpentane is C10H22.
What is the molecular weight of 3-Ethyl-2,2,4-trimethylpentane?
The molecular weight of 3-Ethyl-2,2,4-trimethylpentane is 142.17 g/mol.
Where can I buy 3-Ethyl-2,2,4-trimethylpentane?
You can request a quote for 3-Ethyl-2,2,4-trimethylpentane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Ethyl-2,2,4-trimethylpentane?
Yes, KEHONG BIO provides custom synthesis services for 3-Ethyl-2,2,4-trimethylpentane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.