2-Isopropyl-5-methyl-2-hexenal
TL;DR: 2-Isopropyl-5-methyl-2-hexenal (CAS 35158-25-9) 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.
5-methyl-2-propan-2-ylhex-2-enal
Also Known As: 2-Isopropyl-5-methyl-2-hexenal, isodihydrolavandulal, 2-Isopropyl-5-methylhex-2-enal, 5-Methyl-2-isopropyl-2-hexenal, LAVENDER ALDEHYDE
Application Areas
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C10H18O |
| Molecular Weight | 154.13577 g/mol |
| XLogP | 2.9 |
| 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 | 143.0 |
| Density | 0.840-0.846 |
| Refractive Index | 1.448-1.454 |
| Solubility | Insoluble in water |
| SMILES | CC(C)CC=C(C=O)C(C)C |
| InChIKey | IOLQAHFPDADCHJ-UHFFFAOYSA-N |
Chemical Property Profile of 2-Isopropyl-5-methyl-2-hexenal
Property Insights of 2-Isopropyl-5-methyl-2-hexenal
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Isopropyl-5-methyl-2-hexenal. With a topological polar surface area (TPSA) of 17.1 Ų, 2-Isopropyl-5-methyl-2-hexenal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Isopropyl-5-methyl-2-hexenal 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-Isopropyl-5-methyl-2-hexenal?
The CAS number of 2-Isopropyl-5-methyl-2-hexenal is 35158-25-9.
What is the molecular formula of 2-Isopropyl-5-methyl-2-hexenal?
The molecular formula of 2-Isopropyl-5-methyl-2-hexenal is C10H18O.
What is the molecular weight of 2-Isopropyl-5-methyl-2-hexenal?
The molecular weight of 2-Isopropyl-5-methyl-2-hexenal is 154.13577 g/mol.
Where can I buy 2-Isopropyl-5-methyl-2-hexenal?
You can request a quote for 2-Isopropyl-5-methyl-2-hexenal directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Isopropyl-5-methyl-2-hexenal?
Yes, CoreyChem provides custom synthesis services for 2-Isopropyl-5-methyl-2-hexenal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.