2,4,4-Trimethyl-2-pentene
TL;DR: 2,4,4-Trimethyl-2-pentene (CAS 107-40-4) is a chemical compound with molecular formula C8H16 and molecular weight 112.1252 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,4,4-trimethylpent-2-ene
Also Known As: 2,4,4-TRIMETHYL-2-PENTENE, Diisobutylene, 2,4,4-Trimethylpent-2-ene, beta-Diisobutylene, Diisobutene
Application Areas
Top 5 of 17 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H16 |
| Molecular Weight | 112.1252 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 112.1252 Da |
| Heavy Atoms | 8 |
| Complexity | 87.0 |
| Melting Point | -106.3 °C |
| Boiling Point | 104.9 °C |
| Density | 0.7218 @ 20 °C/4 °C |
| Flash Point | 1.7 °C |
| Vapor Pressure | 35.9 [mmHg] |
| Refractive Index | Index of refraction: 1.4160 @ 20 °C/D |
| Solubility | Insoluble in water; soluble in ethyl ether, benzene, chloroform. |
| SMILES | CC(=CC(C)(C)C)C |
| InChIKey | LAAVYEUJEMRIGF-UHFFFAOYSA-N |
Product Description
Applications: 2,4,4-Trimethyl-2-pentene is used in complex organic molecule assembly across discovery and process chemistry, as well as polymer chemistry and functional materials synthesis. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
2,4,4-Trimethyl-2-pentene is a organic building block identified by CAS number 107-40-4 and the molecular formula C8H16 and a molecular weight of 112.13 g/mol. Physically, the compound has a density of 0.7218 @ 20 °C/4 °C g/cm³, a solubility: Insoluble in water; soluble in ethyl ether, benzene, chloroform. Synonyms include 2,4,4-TRIMETHYL-2-PENTENE and Diisobutylene.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 2,4,4-Trimethyl-2-pentene
Property Insights of 2,4,4-Trimethyl-2-pentene
The XLogP value of 3.6 indicates that 2,4,4-Trimethyl-2-pentene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 2,4,4-Trimethyl-2-pentene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4,4-Trimethyl-2-pentene 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
What is the CAS number of 2,4,4-Trimethyl-2-pentene?
The CAS number of 2,4,4-Trimethyl-2-pentene is 107-40-4.
What is the molecular formula of 2,4,4-Trimethyl-2-pentene?
The molecular formula of 2,4,4-Trimethyl-2-pentene is C8H16.
What is the molecular weight of 2,4,4-Trimethyl-2-pentene?
The molecular weight of 2,4,4-Trimethyl-2-pentene is 112.1252 g/mol.
What are the applications of 2,4,4-Trimethyl-2-pentene?
2,4,4-Trimethyl-2-pentene is used in complex organic molecule assembly across discovery and process chemistry, as well as polymer chemistry and functional materials synthesis. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item...
Where can I buy 2,4,4-Trimethyl-2-pentene?
You can request a quote for 2,4,4-Trimethyl-2-pentene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,4,4-Trimethyl-2-pentene?
Yes, CoreyChem provides custom synthesis services for 2,4,4-Trimethyl-2-pentene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.