Decanoic acid, (2,2-dimethyl-1,3-dioxolan-4-yl)methyl ester
TL;DR: Decanoic acid, (2,2-dimethyl-1,3-dioxolan-4-yl)methyl ester (CAS 57416-00-9) is a chemical compound with molecular formula C16H30O4 and molecular weight 286.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,2-dimethyl-1,3-dioxolan-4-yl)methyl decanoate
Also Known As: Ipococ9, 1,2-Isopropylidene-3-decanoylglycerol, (2,2-Dimethyl-1,3-dioxolan-4-yl)methyl decanoate, (2,2-Dimethyl-1,3-dioxolan-4-yl)methyl decanoate #, Decanoic acid (2,2-dimethyl-1,3-dioxolan-4-yl)methyl ester
| Molecular Formula | C16H30O4 |
|---|---|
| Molecular Weight | 286.21 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 286.21442 |
| Heavy Atoms | 20 |
| Complexity | 276.0 |
Chemical Identifiers
| CAS Number | 57416-00-9 |
|---|---|
| SMILES | CCCCCCCCCC(=O)OCC1COC(O1)(C)C |
| InChIKey | KRBSCYNTGIRIAV-UHFFFAOYSA-N |
Product Overview
Decanoic acid, (2,2-dimethyl-1,3-dioxolan-4-yl)methyl ester (CAS 57416-00-9), with molecular formula C16H30O4 and molecular weight 286.21 g/mol. IUPAC: (2,2-dimethyl-1,3-dioxolan-4-yl)methyl decanoate.
Chemical Property Profile of Decanoic acid, (2,2-dimethyl-1,3-dioxolan-4-yl)methyl ester
Property Insights of Decanoic acid, (2,2-dimethyl-1,3-dioxolan-4-yl)methyl ester
The XLogP value of 4.5 indicates that Decanoic acid, (2,2-dimethyl-1,3-dioxolan-4-yl)methyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.8 Ų, Decanoic acid, (2,2-dimethyl-1,3-dioxolan-4-yl)methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Decanoic acid, (2,2-dimethyl-1,3-dioxolan-4-yl)methyl ester has 0 hydrogen bond donor(s) and 4 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 Decanoic acid, (2,2-dimethyl-1,3-dioxolan-4-yl)methyl ester?
The CAS number of Decanoic acid, (2,2-dimethyl-1,3-dioxolan-4-yl)methyl ester is 57416-00-9.
What is the molecular formula of Decanoic acid, (2,2-dimethyl-1,3-dioxolan-4-yl)methyl ester?
The molecular formula of Decanoic acid, (2,2-dimethyl-1,3-dioxolan-4-yl)methyl ester is C16H30O4.
What is the molecular weight of Decanoic acid, (2,2-dimethyl-1,3-dioxolan-4-yl)methyl ester?
The molecular weight of Decanoic acid, (2,2-dimethyl-1,3-dioxolan-4-yl)methyl ester is 286.21 g/mol.
Where can I buy Decanoic acid, (2,2-dimethyl-1,3-dioxolan-4-yl)methyl ester?
You can request a quote for Decanoic acid, (2,2-dimethyl-1,3-dioxolan-4-yl)methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Decanoic acid, (2,2-dimethyl-1,3-dioxolan-4-yl)methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Decanoic acid, (2,2-dimethyl-1,3-dioxolan-4-yl)methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.