2-Propylpentanal diethyl acetal
TL;DR: 2-Propylpentanal diethyl acetal (CAS 124345-17-1) is a chemical compound with molecular formula CCCC(CCC)C(OCC)OCC and molecular weight 202.19328 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(diethoxymethyl)heptane
Also Known As: 4-(diethoxymethyl)heptane, 4-Diethoxymethylheptane, 2-Propylpentanal diethyl acetal, Heptane, 4-(diethoxymethyl)-, Heptane,4-(diethoxymethyl)-
Technical Specifications
| Molecular Formula | CCCC(CCC)C(OCC)OCC |
| Molecular Weight | 202.19328 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Exact Mass | 202.19328 Da |
| Heavy Atoms | 14 |
| Complexity | 103.0 |
| SMILES | CCCC(CCC)C(OCC)OCC |
| InChIKey | TWXSZPRZLKECAG-UHFFFAOYSA-N |
Chemical Property Profile of 2-Propylpentanal diethyl acetal
Property Insights of 2-Propylpentanal diethyl acetal
The XLogP value of 4.0 indicates that 2-Propylpentanal diethyl acetal is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, 2-Propylpentanal diethyl acetal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propylpentanal diethyl acetal 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
What is the CAS number of 2-Propylpentanal diethyl acetal?
The CAS number of 2-Propylpentanal diethyl acetal is 124345-17-1.
What is the molecular formula of 2-Propylpentanal diethyl acetal?
The molecular formula of 2-Propylpentanal diethyl acetal is CCCC(CCC)C(OCC)OCC.
What is the molecular weight of 2-Propylpentanal diethyl acetal?
The molecular weight of 2-Propylpentanal diethyl acetal is 202.19328 g/mol.
Where can I buy 2-Propylpentanal diethyl acetal?
You can request a quote for 2-Propylpentanal diethyl acetal directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Propylpentanal diethyl acetal?
Yes, CoreyChem provides custom synthesis services for 2-Propylpentanal diethyl acetal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.