Hydroxycitronellal diethyl acetal
TL;DR: Hydroxycitronellal diethyl acetal (CAS 7779-94-4) is a chemical compound with molecular formula C14H30O3 and molecular weight 246.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8,8-diethoxy-2,6-dimethyloctan-2-ol
Also Known As: Hydroxycitronellal diethyl acetal, 8,8-Diethoxy-2,6-dimethyloctan-2-ol, FEMA No. 2584, 8,8-Diethoxy-2,6-dimethyl-2-octanol, 2-Octanol, 8,8-diethoxy-2,6-dimethyl-
| Molecular Formula | C14H30O3 |
|---|---|
| Molecular Weight | 246.22 g/mol |
| LogP | 3.3529 |
| Topological Polar Surface Area | 38.69 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 246.2195 |
| Heavy Atoms | 17 |
| Complexity | 168.79636 |
Chemical Identifiers
| CAS Number | 7779-94-4 |
|---|---|
| SMILES | CCOC(CC(C)CCCC(C)(C)O)OCC |
Product Overview
Hydroxycitronellal diethyl acetal (CAS 7779-94-4), with molecular formula C14H30O3 and molecular weight 246.22 g/mol. IUPAC: 8,8-diethoxy-2,6-dimethyloctan-2-ol.
Chemical Property Profile of Hydroxycitronellal diethyl acetal
Property Insights of Hydroxycitronellal diethyl acetal
The XLogP value of 3.3529 indicates that Hydroxycitronellal diethyl acetal is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.69 Ų, Hydroxycitronellal diethyl acetal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hydroxycitronellal diethyl acetal 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 Hydroxycitronellal diethyl acetal?
The CAS number of Hydroxycitronellal diethyl acetal is 7779-94-4.
What is the molecular formula of Hydroxycitronellal diethyl acetal?
The molecular formula of Hydroxycitronellal diethyl acetal is C14H30O3.
What is the molecular weight of Hydroxycitronellal diethyl acetal?
The molecular weight of Hydroxycitronellal diethyl acetal is 246.22 g/mol.
Where can I buy Hydroxycitronellal diethyl acetal?
You can request a quote for Hydroxycitronellal diethyl acetal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hydroxycitronellal diethyl acetal?
Yes, KEHONG BIO provides custom synthesis services for Hydroxycitronellal diethyl acetal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.