(E)-3-methyldec-3-en-2-one
TL;DR: (E)-3-methyldec-3-en-2-one (CAS 54411-03-9) is a chemical compound with molecular formula C11H20O and molecular weight 168.15141 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-methyldec-3-en-2-one
Also Known As: 3-methyldec-3-en-2-one, (E)-3-methyldec-3-en-2-one, 1-Nonene,4,6,8-trimethyl, 3-Decen-2-one, 3-methyl-, 3-METHYL-3-DECEN-2-ONE
Technical Specifications
| Molecular Formula | C11H20O |
| Molecular Weight | 168.15141 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 168.15141 Da |
| Heavy Atoms | 12 |
| Complexity | 156.0 |
| SMILES | CCCCCCC=C(C)C(=O)C |
| InChIKey | FKAXTVXZKQJKBJ-UHFFFAOYSA-N |
Chemical Property Profile of (E)-3-methyldec-3-en-2-one
Property Insights of (E)-3-methyldec-3-en-2-one
The XLogP value of 3.7 indicates that (E)-3-methyldec-3-en-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, (E)-3-methyldec-3-en-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-3-methyldec-3-en-2-one 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 (E)-3-methyldec-3-en-2-one?
The CAS number of (E)-3-methyldec-3-en-2-one is 54411-03-9.
What is the molecular formula of (E)-3-methyldec-3-en-2-one?
The molecular formula of (E)-3-methyldec-3-en-2-one is C11H20O.
What is the molecular weight of (E)-3-methyldec-3-en-2-one?
The molecular weight of (E)-3-methyldec-3-en-2-one is 168.15141 g/mol.
Where can I buy (E)-3-methyldec-3-en-2-one?
You can request a quote for (E)-3-methyldec-3-en-2-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (E)-3-methyldec-3-en-2-one?
Yes, CoreyChem provides custom synthesis services for (E)-3-methyldec-3-en-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.