Decan-2-yl propanoate
TL;DR: Decan-2-yl propanoate (CAS 55683-11-9) is a chemical compound with molecular formula C13H26O2 and molecular weight 214.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
decan-2-yl propanoate
Also Known As: decan-2-yl propanoate, 2-decanyl propionate, 2-Decanol, propanoate, 2-Decanol propionate, 1-Methylnonyl propionate
| Molecular Formula | C13H26O2 |
|---|---|
| Molecular Weight | 214.19 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 10 |
| Exact Mass | 214.19328 |
| Heavy Atoms | 15 |
| Complexity | 155.0 |
Chemical Identifiers
| CAS Number | 55683-11-9 |
|---|---|
| SMILES | CCCCCCCCC(C)OC(=O)CC |
| InChIKey | HJQHFVTZMYPNGS-UHFFFAOYSA-N |
Product Overview
Decan-2-yl propanoate (CAS 55683-11-9), with molecular formula C13H26O2 and molecular weight 214.19 g/mol. IUPAC: decan-2-yl propanoate.
Chemical Property Profile of Decan-2-yl propanoate
Property Insights of Decan-2-yl propanoate
The XLogP value of 5.0 indicates that Decan-2-yl propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Decan-2-yl propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Decan-2-yl propanoate 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 Decan-2-yl propanoate?
The CAS number of Decan-2-yl propanoate is 55683-11-9.
What is the molecular formula of Decan-2-yl propanoate?
The molecular formula of Decan-2-yl propanoate is C13H26O2.
What is the molecular weight of Decan-2-yl propanoate?
The molecular weight of Decan-2-yl propanoate is 214.19 g/mol.
Where can I buy Decan-2-yl propanoate?
You can request a quote for Decan-2-yl propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Decan-2-yl propanoate?
Yes, KEHONG BIO provides custom synthesis services for Decan-2-yl propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.