2,4,5-Trimethylheptane
TL;DR: 2,4,5-Trimethylheptane (CAS 20278-84-6) is a chemical compound with molecular formula C10H22 and molecular weight 142.17215 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,4,5-trimethylheptane
Also Known As: 2,4,5-Trimethylheptane, Heptane, 2,4,5-trimethyl-, C10-H22, J1.608.992C
Application Areas
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C10H22 |
| Molecular Weight | 142.17215 g/mol |
| XLogP | 4.8 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 4 |
| Exact Mass | 142.17215 Da |
| Heavy Atoms | 10 |
| Complexity | 74.0 |
| SMILES | CCC(C)C(C)CC(C)C |
| InChIKey | YMBNRMDSLJNNPF-UHFFFAOYSA-N |
Chemical Property Profile of 2,4,5-Trimethylheptane
Property Insights of 2,4,5-Trimethylheptane
The XLogP value of 4.8 indicates that 2,4,5-Trimethylheptane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 2,4,5-Trimethylheptane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4,5-Trimethylheptane 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 2,4,5-Trimethylheptane?
The CAS number of 2,4,5-Trimethylheptane is 20278-84-6.
What is the molecular formula of 2,4,5-Trimethylheptane?
The molecular formula of 2,4,5-Trimethylheptane is C10H22.
What is the molecular weight of 2,4,5-Trimethylheptane?
The molecular weight of 2,4,5-Trimethylheptane is 142.17215 g/mol.
Where can I buy 2,4,5-Trimethylheptane?
You can request a quote for 2,4,5-Trimethylheptane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,4,5-Trimethylheptane?
Yes, CoreyChem provides custom synthesis services for 2,4,5-Trimethylheptane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.