(E)-3,7-Dimethylocta-2,6-dienyl 5-oxo-DL-prolinate
TL;DR: (E)-3,7-Dimethylocta-2,6-dienyl 5-oxo-DL-prolinate (CAS 64431-72-7) is a chemical compound with molecular formula C15H23NO3 and molecular weight 265.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2E)-3,7-dimethylocta-2,6-dienyl] 5-oxopyrrolidine-2-carboxylate
Also Known As: EINECS 264-897-2, (E)-3,7-Dimethylocta-2,6-dienyl 5-oxo-DL-prolinate, -3,7-dimethylocta-2,6-dienyl5-oxo-DL-prolinate, (2E)-3,7-Dimethylocta-2,6-dien-1-yl 5-oxoprolinate, Proline, 5-oxo-, 3,7-dimethyl-2,6-octadienyl ester, (E)-
| Molecular Formula | C15H23NO3 |
|---|---|
| Molecular Weight | 265.17 g/mol |
| LogP | 2.5009 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 265.1678 |
| Heavy Atoms | 19 |
| Complexity | 392.19485 |
Chemical Identifiers
| CAS Number | 64431-72-7 |
|---|---|
| SMILES | CC(=CCC/C(=C/COC(=O)C1CCC(=O)N1)/C)C |
Product Overview
(E)-3,7-Dimethylocta-2,6-dienyl 5-oxo-DL-prolinate (CAS 64431-72-7), with molecular formula C15H23NO3 and molecular weight 265.17 g/mol. IUPAC: [(2E)-3,7-dimethylocta-2,6-dienyl] 5-oxopyrrolidine-2-carboxylate.
Chemical Property Profile of (E)-3,7-Dimethylocta-2,6-dienyl 5-oxo-DL-prolinate
Property Insights of (E)-3,7-Dimethylocta-2,6-dienyl 5-oxo-DL-prolinate
The XLogP value of 2.5009 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-3,7-Dimethylocta-2,6-dienyl 5-oxo-DL-prolinate. With a topological polar surface area (TPSA) of 55.4 Ų, (E)-3,7-Dimethylocta-2,6-dienyl 5-oxo-DL-prolinate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-3,7-Dimethylocta-2,6-dienyl 5-oxo-DL-prolinate 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
Frequently Asked Questions
What is the CAS number of (E)-3,7-Dimethylocta-2,6-dienyl 5-oxo-DL-prolinate?
The CAS number of (E)-3,7-Dimethylocta-2,6-dienyl 5-oxo-DL-prolinate is 64431-72-7.
What is the molecular formula of (E)-3,7-Dimethylocta-2,6-dienyl 5-oxo-DL-prolinate?
The molecular formula of (E)-3,7-Dimethylocta-2,6-dienyl 5-oxo-DL-prolinate is C15H23NO3.
What is the molecular weight of (E)-3,7-Dimethylocta-2,6-dienyl 5-oxo-DL-prolinate?
The molecular weight of (E)-3,7-Dimethylocta-2,6-dienyl 5-oxo-DL-prolinate is 265.17 g/mol.
Where can I buy (E)-3,7-Dimethylocta-2,6-dienyl 5-oxo-DL-prolinate?
You can request a quote for (E)-3,7-Dimethylocta-2,6-dienyl 5-oxo-DL-prolinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-3,7-Dimethylocta-2,6-dienyl 5-oxo-DL-prolinate?
Yes, KEHONG BIO provides custom synthesis services for (E)-3,7-Dimethylocta-2,6-dienyl 5-oxo-DL-prolinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.