Hydroxycitronellal dimethyl acetal
TL;DR: Hydroxycitronellal dimethyl acetal (CAS 141-92-4) is a chemical compound with molecular formula C12H26O3 and molecular weight 218.1882 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
8,8-dimethoxy-2,6-dimethyloctan-2-ol
Also Known As: Hydroxycitronellal dimethyl acetal, 8,8-Dimethoxy-2,6-dimethyloctan-2-ol, Laurine dimethyl acetal, Hydroxycitronellal DMA, 8,8-Dimethoxy-2,6-dimethyl-2-octanol
Application Areas
Top 5 of 12 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H26O3 |
| Molecular Weight | 218.1882 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 38.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 218.1882 Da |
| Heavy Atoms | 15 |
| Complexity | 153.0 |
| Boiling Point | 252.00 °C. @ 760.00 mm Hg |
| Density | 0.925-0.930 |
| Refractive Index | 1.441-1.444 |
| Solubility | insoluble in water and glycerol; slightly soluble in alcohol; soluble in oils |
| SMILES | CC(CCCC(C)(C)O)CC(OC)OC |
| InChIKey | QCJVKUULZGKQDG-UHFFFAOYSA-N |
Product Description
Applications: Hydroxycitronellal dimethyl acetal is used in pharmaceutical synthesis routes and API production, as well as agrochemical development, including crop protection agent synthesis. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Hydroxycitronellal dimethyl acetal (CAS 141-92-4) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
Hydroxycitronellal dimethyl acetal is a pharmaceutical intermediate identified by CAS number 141-92-4 and the molecular formula C12H26O3 and a molecular weight of 218.19 g/mol. Physically, the compound has a density of 0.925-0.930 g/cm³, a solubility: insoluble in water and glycerol; slightly soluble in alcohol; soluble in oils. It is also known as Hydroxycitronellal dimethyl acetal and 8,8-Dimethoxy-2,6-dimethyloctan-2-ol.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Hydroxycitronellal dimethyl acetal
Property Insights of Hydroxycitronellal dimethyl acetal
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hydroxycitronellal dimethyl acetal. With a topological polar surface area (TPSA) of 38.7 Ų, Hydroxycitronellal dimethyl acetal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hydroxycitronellal dimethyl 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
What is the CAS number of Hydroxycitronellal dimethyl acetal?
The CAS number of Hydroxycitronellal dimethyl acetal is 141-92-4.
What is the molecular formula of Hydroxycitronellal dimethyl acetal?
The molecular formula of Hydroxycitronellal dimethyl acetal is C12H26O3.
What is the molecular weight of Hydroxycitronellal dimethyl acetal?
The molecular weight of Hydroxycitronellal dimethyl acetal is 218.1882 g/mol.
What are the applications of Hydroxycitronellal dimethyl acetal?
Hydroxycitronellal dimethyl acetal is used in pharmaceutical synthesis routes and API production, as well as agrochemical development, including crop protection agent synthesis. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Hydroxycitronellal dimethyl...
Where can I buy Hydroxycitronellal dimethyl acetal?
You can request a quote for Hydroxycitronellal dimethyl acetal directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Hydroxycitronellal dimethyl acetal?
Yes, CoreyChem provides custom synthesis services for Hydroxycitronellal dimethyl acetal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.