2,4-Hexadienyl propionate, (2E,4E)-
TL;DR: 2,4-Hexadienyl propionate, (2E,4E)- (CAS 167937-11-3) is a chemical compound with molecular formula C9H14O2 and molecular weight 154.09938 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(2E,4E)-hexa-2,4-dienyl] propanoate
Also Known As: Sorbyl propionate, 2,4-Hexadienyl propionate, 2,4-Hexadienol monopropionate, 2,4-Hexadien-1-ol, propionate, FEMA No. 4131
Technical Specifications
| Molecular Formula | C9H14O2 |
| Molecular Weight | 154.09938 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 154.09938 Da |
| Heavy Atoms | 11 |
| Complexity | 157.0 |
| SMILES | CCC(=O)OC/C=C/C=C/C |
| InChIKey | ZVBREIRNEOXCKQ-TWTPFVCWSA-N |
Chemical Property Profile of 2,4-Hexadienyl propionate, (2E,4E)-
Property Insights of 2,4-Hexadienyl propionate, (2E,4E)-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Hexadienyl propionate, (2E,4E)-. With a topological polar surface area (TPSA) of 26.3 Ų, 2,4-Hexadienyl propionate, (2E,4E)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-Hexadienyl propionate, (2E,4E)- has 0 hydrogen bond donor(s) and 2 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-Hexadienyl propionate, (2E,4E)-?
The CAS number of 2,4-Hexadienyl propionate, (2E,4E)- is 167937-11-3.
What is the molecular formula of 2,4-Hexadienyl propionate, (2E,4E)-?
The molecular formula of 2,4-Hexadienyl propionate, (2E,4E)- is C9H14O2.
What is the molecular weight of 2,4-Hexadienyl propionate, (2E,4E)-?
The molecular weight of 2,4-Hexadienyl propionate, (2E,4E)- is 154.09938 g/mol.
Where can I buy 2,4-Hexadienyl propionate, (2E,4E)-?
You can request a quote for 2,4-Hexadienyl propionate, (2E,4E)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,4-Hexadienyl propionate, (2E,4E)-?
Yes, CoreyChem provides custom synthesis services for 2,4-Hexadienyl propionate, (2E,4E)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.