1,1-Diethoxyhex-3-ene
TL;DR: 1,1-Diethoxyhex-3-ene (CAS 73545-18-3) is a chemical compound with molecular formula C10H20O2 and molecular weight 172.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1-diethoxyhex-3-ene
Also Known As: 1,1-diethoxyhex-3-ene, cis-3-HEXENYL ACETAL, (Z)-3-hexen-1-al diethyl acetal, 3-Hexene,1,1-diethoxy-, (3Z)-
| Molecular Formula | C10H20O2 |
|---|---|
| Molecular Weight | 172.15 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 172.14633 |
| Heavy Atoms | 12 |
| Complexity | 104.0 |
Chemical Identifiers
| CAS Number | 73545-18-3 |
|---|---|
| SMILES | CCC=CCC(OCC)OCC |
| InChIKey | IOBHVJHSBREPFR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,1-Diethoxyhex-3-ene (CAS 73545-18-3), with molecular formula C10H20O2 and molecular weight 172.15 g/mol. IUPAC: 1,1-diethoxyhex-3-ene.
Chemical Property Profile of 1,1-Diethoxyhex-3-ene
Property Insights of 1,1-Diethoxyhex-3-ene
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1-Diethoxyhex-3-ene. With a topological polar surface area (TPSA) of 18.5 Ų, 1,1-Diethoxyhex-3-ene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1-Diethoxyhex-3-ene 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
Frequently Asked Questions
What is the CAS number of 1,1-Diethoxyhex-3-ene?
The CAS number of 1,1-Diethoxyhex-3-ene is 73545-18-3.
What is the molecular formula of 1,1-Diethoxyhex-3-ene?
The molecular formula of 1,1-Diethoxyhex-3-ene is C10H20O2.
What is the molecular weight of 1,1-Diethoxyhex-3-ene?
The molecular weight of 1,1-Diethoxyhex-3-ene is 172.15 g/mol.
Where can I buy 1,1-Diethoxyhex-3-ene?
You can request a quote for 1,1-Diethoxyhex-3-ene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1-Diethoxyhex-3-ene?
Yes, KEHONG BIO provides custom synthesis services for 1,1-Diethoxyhex-3-ene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.