2-Methylene-3,5,5-trimethylhexanal
TL;DR: 2-Methylene-3,5,5-trimethylhexanal (CAS 22414-70-6) is a chemical compound with molecular formula C10H18O and molecular weight 154.13577 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,5,5-trimethyl-2-methylidenehexanal
Also Known As: 2-Methylene-3,5,5-trimethylhexanal, 3,5,5-trimethyl-2-methylenehexanal, 3,5,5-trimethyl-2-methylidenehexanal, Hexanal,3,5,5-trimethyl-2-methylene-, [rac]-2-Methylene-3,5,5-trimethylhexanal
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C10H18O |
| Molecular Weight | 154.13577 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 154.13577 Da |
| Heavy Atoms | 11 |
| Complexity | 151.0 |
| SMILES | CC(CC(C)(C)C)C(=C)C=O |
| InChIKey | WKYDOWGZVLXESO-UHFFFAOYSA-N |
Chemical Property Profile of 2-Methylene-3,5,5-trimethylhexanal
Property Insights of 2-Methylene-3,5,5-trimethylhexanal
The XLogP value of 3.2 indicates that 2-Methylene-3,5,5-trimethylhexanal is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 2-Methylene-3,5,5-trimethylhexanal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methylene-3,5,5-trimethylhexanal has 0 hydrogen bond donor(s) and 1 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-Methylene-3,5,5-trimethylhexanal?
The CAS number of 2-Methylene-3,5,5-trimethylhexanal is 22414-70-6.
What is the molecular formula of 2-Methylene-3,5,5-trimethylhexanal?
The molecular formula of 2-Methylene-3,5,5-trimethylhexanal is C10H18O.
What is the molecular weight of 2-Methylene-3,5,5-trimethylhexanal?
The molecular weight of 2-Methylene-3,5,5-trimethylhexanal is 154.13577 g/mol.
Where can I buy 2-Methylene-3,5,5-trimethylhexanal?
You can request a quote for 2-Methylene-3,5,5-trimethylhexanal directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Methylene-3,5,5-trimethylhexanal?
Yes, CoreyChem provides custom synthesis services for 2-Methylene-3,5,5-trimethylhexanal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.