2,4-Hexadienoic acid, 2-hydroxy-1-methylethyl ester, (2E,4E)-
TL;DR: 2,4-Hexadienoic acid, 2-hydroxy-1-methylethyl ester, (2E,4E)- (CAS 132682-65-6) is a chemical compound with molecular formula C9H14O3 and molecular weight 170.0943 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(2R)-1-hydroxypropan-2-yl] (2E,4E)-hexa-2,4-dienoate
Also Known As: 2,4-Hexadienoic acid, 2-hydroxy-1-methylethyl ester, (2E,4E)-, (R)-4-((E)-Styryl)-oxazolidin-2-one, [(2R)-1-hydroxypropan-2-yl] (2E,4E)-hexa-2,4-dienoate
Technical Specifications
| Molecular Formula | C9H14O3 |
| Molecular Weight | 170.0943 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 170.0943 Da |
| Heavy Atoms | 12 |
| Complexity | 182.0 |
| SMILES | C/C=C/C=C/C(=O)O[C@H](C)CO |
| InChIKey | RPQCPPFYBQCYNB-IUNRWVRJSA-N |
Chemical Property Profile of 2,4-Hexadienoic acid, 2-hydroxy-1-methylethyl ester, (2E,4E)-
Property Insights of 2,4-Hexadienoic acid, 2-hydroxy-1-methylethyl ester, (2E,4E)-
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Hexadienoic acid, 2-hydroxy-1-methylethyl ester, (2E,4E)-. With a topological polar surface area (TPSA) of 46.5 Ų, 2,4-Hexadienoic acid, 2-hydroxy-1-methylethyl ester, (2E,4E)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-Hexadienoic acid, 2-hydroxy-1-methylethyl ester, (2E,4E)- has 1 hydrogen bond donor(s) and 3 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-Hexadienoic acid, 2-hydroxy-1-methylethyl ester, (2E,4E)-?
The CAS number of 2,4-Hexadienoic acid, 2-hydroxy-1-methylethyl ester, (2E,4E)- is 132682-65-6.
What is the molecular formula of 2,4-Hexadienoic acid, 2-hydroxy-1-methylethyl ester, (2E,4E)-?
The molecular formula of 2,4-Hexadienoic acid, 2-hydroxy-1-methylethyl ester, (2E,4E)- is C9H14O3.
What is the molecular weight of 2,4-Hexadienoic acid, 2-hydroxy-1-methylethyl ester, (2E,4E)-?
The molecular weight of 2,4-Hexadienoic acid, 2-hydroxy-1-methylethyl ester, (2E,4E)- is 170.0943 g/mol.
Where can I buy 2,4-Hexadienoic acid, 2-hydroxy-1-methylethyl ester, (2E,4E)-?
You can request a quote for 2,4-Hexadienoic acid, 2-hydroxy-1-methylethyl ester, (2E,4E)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,4-Hexadienoic acid, 2-hydroxy-1-methylethyl ester, (2E,4E)-?
Yes, CoreyChem provides custom synthesis services for 2,4-Hexadienoic acid, 2-hydroxy-1-methylethyl ester, (2E,4E)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.