2-Propylpentanal diisopropyl acetal
TL;DR: 2-Propylpentanal diisopropyl acetal (CAS 124345-19-3) is a chemical compound with molecular formula C14H30O2 and molecular weight 230.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[di(propan-2-yloxy)methyl]heptane
Also Known As: Ppdiia, 2-Propylpentanal diisopropyl acetal, 4-[di(propan-2-yloxy)methyl]heptane, Heptane,4-[bis(1-methylethoxy)methyl]-, 4-{Bis[(propan-2-yl)oxy]methyl}heptane
| Molecular Formula | C14H30O2 |
|---|---|
| Molecular Weight | 230.22 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Exact Mass | 230.22458 |
| Heavy Atoms | 16 |
| Complexity | 139.0 |
Chemical Identifiers
| CAS Number | 124345-19-3 |
|---|---|
| SMILES | CCCC(CCC)C(OC(C)C)OC(C)C |
| InChIKey | JCNGRKBVAFNNHL-UHFFFAOYSA-N |
Product Overview
2-Propylpentanal diisopropyl acetal (CAS 124345-19-3), with molecular formula C14H30O2 and molecular weight 230.22 g/mol. IUPAC: 4-[di(propan-2-yloxy)methyl]heptane.
Chemical Property Profile of 2-Propylpentanal diisopropyl acetal
Property Insights of 2-Propylpentanal diisopropyl acetal
The XLogP value of 4.8 indicates that 2-Propylpentanal diisopropyl 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 diisopropyl acetal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propylpentanal diisopropyl 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
Frequently Asked Questions
What is the CAS number of 2-Propylpentanal diisopropyl acetal?
The CAS number of 2-Propylpentanal diisopropyl acetal is 124345-19-3.
What is the molecular formula of 2-Propylpentanal diisopropyl acetal?
The molecular formula of 2-Propylpentanal diisopropyl acetal is C14H30O2.
What is the molecular weight of 2-Propylpentanal diisopropyl acetal?
The molecular weight of 2-Propylpentanal diisopropyl acetal is 230.22 g/mol.
Where can I buy 2-Propylpentanal diisopropyl acetal?
You can request a quote for 2-Propylpentanal diisopropyl acetal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propylpentanal diisopropyl acetal?
Yes, KEHONG BIO provides custom synthesis services for 2-Propylpentanal diisopropyl acetal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.