2,4-Diethyl-2,6-heptadienal
TL;DR: 2,4-Diethyl-2,6-heptadienal (CAS 85136-07-8) is a chemical compound with molecular formula C11H18O and molecular weight 166.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-diethylhepta-2,6-dienal
Also Known As: 2,4-Diethylhepta-2,6-dienal, 2,4-DIETHYL-2,6-HEPTADIENAL, 2,6-Heptadienal, 2,4-diethyl-, diethyl heptadienal (mixture of isomers), 2,4-Diethyl-2,6-heptadienal, mixture of isomers
| Molecular Formula | C11H18O |
|---|---|
| Molecular Weight | 166.14 g/mol |
| LogP | 3.124 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 166.13577 |
| Heavy Atoms | 12 |
| Complexity | 167.84293 |
Chemical Identifiers
| CAS Number | 85136-07-8 |
|---|---|
| SMILES | CCC(CC=C)C=C(CC)C=O |
Product Overview
2,4-Diethyl-2,6-heptadienal (CAS 85136-07-8), with molecular formula C11H18O and molecular weight 166.14 g/mol. IUPAC: 2,4-diethylhepta-2,6-dienal.
Chemical Property Profile of 2,4-Diethyl-2,6-heptadienal
Property Insights of 2,4-Diethyl-2,6-heptadienal
The XLogP value of 3.124 indicates that 2,4-Diethyl-2,6-heptadienal is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 2,4-Diethyl-2,6-heptadienal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-Diethyl-2,6-heptadienal 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
Frequently Asked Questions
What is the CAS number of 2,4-Diethyl-2,6-heptadienal?
The CAS number of 2,4-Diethyl-2,6-heptadienal is 85136-07-8.
What is the molecular formula of 2,4-Diethyl-2,6-heptadienal?
The molecular formula of 2,4-Diethyl-2,6-heptadienal is C11H18O.
What is the molecular weight of 2,4-Diethyl-2,6-heptadienal?
The molecular weight of 2,4-Diethyl-2,6-heptadienal is 166.14 g/mol.
Where can I buy 2,4-Diethyl-2,6-heptadienal?
You can request a quote for 2,4-Diethyl-2,6-heptadienal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Diethyl-2,6-heptadienal?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Diethyl-2,6-heptadienal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.