2-(2-Butoxyethoxy)ethyl heptanoate
TL;DR: 2-(2-Butoxyethoxy)ethyl heptanoate (CAS 6313-52-6) is a chemical compound with molecular formula C15H30O4 and molecular weight 274.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-butoxyethoxy)ethyl heptanoate
Also Known As: 2-(2-butoxyethoxy)ethyl heptanoate, Heptanoic acid,2-(2-butoxyethoxy)ethyl ester, RefChem:250523
| Molecular Formula | C15H30O4 |
|---|---|
| Molecular Weight | 274.21 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 15 |
| Exact Mass | 274.21442 |
| Heavy Atoms | 19 |
| Complexity | 195.0 |
Chemical Identifiers
| CAS Number | 6313-52-6 |
|---|---|
| SMILES | CCCCCCC(=O)OCCOCCOCCCC |
| InChIKey | JYNTZJFEZCZUHK-UHFFFAOYSA-N |
Product Overview
2-(2-Butoxyethoxy)ethyl heptanoate (CAS 6313-52-6), with molecular formula C15H30O4 and molecular weight 274.21 g/mol. IUPAC: 2-(2-butoxyethoxy)ethyl heptanoate.
Chemical Property Profile of 2-(2-Butoxyethoxy)ethyl heptanoate
Property Insights of 2-(2-Butoxyethoxy)ethyl heptanoate
The XLogP value of 3.5 indicates that 2-(2-Butoxyethoxy)ethyl heptanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.8 Ų, 2-(2-Butoxyethoxy)ethyl heptanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Butoxyethoxy)ethyl heptanoate 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 2-(2-Butoxyethoxy)ethyl heptanoate?
The CAS number of 2-(2-Butoxyethoxy)ethyl heptanoate is 6313-52-6.
What is the molecular formula of 2-(2-Butoxyethoxy)ethyl heptanoate?
The molecular formula of 2-(2-Butoxyethoxy)ethyl heptanoate is C15H30O4.
What is the molecular weight of 2-(2-Butoxyethoxy)ethyl heptanoate?
The molecular weight of 2-(2-Butoxyethoxy)ethyl heptanoate is 274.21 g/mol.
Where can I buy 2-(2-Butoxyethoxy)ethyl heptanoate?
You can request a quote for 2-(2-Butoxyethoxy)ethyl heptanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Butoxyethoxy)ethyl heptanoate?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Butoxyethoxy)ethyl heptanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.