2-Butoxyethyl hexanoate
TL;DR: 2-Butoxyethyl hexanoate (CAS 6278-79-1) is a chemical compound with molecular formula C12H24O3 and molecular weight 216.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-butoxyethyl hexanoate
Also Known As: 2-butoxyethyl hexanoate, Hexanoic acid,2-butoxyethyl ester
| Molecular Formula | C12H24O3 |
|---|---|
| Molecular Weight | 216.17 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 11 |
| Exact Mass | 216.17255 |
| Heavy Atoms | 15 |
| Complexity | 146.0 |
Chemical Identifiers
| CAS Number | 6278-79-1 |
|---|---|
| SMILES | CCCCCC(=O)OCCOCCCC |
| InChIKey | HAYKAPIQQMKKJA-UHFFFAOYSA-N |
Product Overview
2-Butoxyethyl hexanoate (CAS 6278-79-1), with molecular formula C12H24O3 and molecular weight 216.17 g/mol. IUPAC: 2-butoxyethyl hexanoate.
Chemical Property Profile of 2-Butoxyethyl hexanoate
Property Insights of 2-Butoxyethyl hexanoate
The XLogP value of 3.1 indicates that 2-Butoxyethyl hexanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, 2-Butoxyethyl hexanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Butoxyethyl hexanoate has 0 hydrogen bond donor(s) and 3 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-Butoxyethyl hexanoate?
The CAS number of 2-Butoxyethyl hexanoate is 6278-79-1.
What is the molecular formula of 2-Butoxyethyl hexanoate?
The molecular formula of 2-Butoxyethyl hexanoate is C12H24O3.
What is the molecular weight of 2-Butoxyethyl hexanoate?
The molecular weight of 2-Butoxyethyl hexanoate is 216.17 g/mol.
Where can I buy 2-Butoxyethyl hexanoate?
You can request a quote for 2-Butoxyethyl hexanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Butoxyethyl hexanoate?
Yes, KEHONG BIO provides custom synthesis services for 2-Butoxyethyl hexanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.