Butane-2,3-diyl dioctanoate
TL;DR: Butane-2,3-diyl dioctanoate (CAS 65861-64-5) is a chemical compound with molecular formula C20H38O4 and molecular weight 342.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-octanoyloxybutan-2-yl octanoate
Also Known As: 2,3-Butanediol dioctanoate, Butane-2,3-diyl dioctanoate, 1,2-Dimethyl-1,2-ethanediyl octanoate, 3-octanoyloxybutan-2-yl octanoate, Dioctanoic acid 2,3-butanediyl
| Molecular Formula | C20H38O4 |
|---|---|
| Molecular Weight | 342.28 g/mol |
| LogP | 5.5708 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 15 |
| Exact Mass | 342.277 |
| Heavy Atoms | 24 |
| Complexity | 295.60052 |
Chemical Identifiers
| CAS Number | 65861-64-5 |
|---|---|
| SMILES | CCCCCCCC(=O)OC(C)C(C)OC(=O)CCCCCCC |
Product Overview
Butane-2,3-diyl dioctanoate (CAS 65861-64-5), with molecular formula C20H38O4 and molecular weight 342.28 g/mol. IUPAC: 3-octanoyloxybutan-2-yl octanoate.
Chemical Property Profile of Butane-2,3-diyl dioctanoate
Property Insights of Butane-2,3-diyl dioctanoate
The XLogP value of 5.5708 indicates that Butane-2,3-diyl dioctanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Butane-2,3-diyl dioctanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butane-2,3-diyl dioctanoate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Butane-2,3-diyl dioctanoate?
The CAS number of Butane-2,3-diyl dioctanoate is 65861-64-5.
What is the molecular formula of Butane-2,3-diyl dioctanoate?
The molecular formula of Butane-2,3-diyl dioctanoate is C20H38O4.
What is the molecular weight of Butane-2,3-diyl dioctanoate?
The molecular weight of Butane-2,3-diyl dioctanoate is 342.28 g/mol.
Where can I buy Butane-2,3-diyl dioctanoate?
You can request a quote for Butane-2,3-diyl dioctanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butane-2,3-diyl dioctanoate?
Yes, KEHONG BIO provides custom synthesis services for Butane-2,3-diyl dioctanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.