癸二酸-2-丁氧基乙酯
TL;DR: 癸二酸-2-丁氧基乙酯 (CAS 68186-66-3) is a chemical compound with molecular formula C16H30O5 and molecular weight 302.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
癸二酸-2-丁氧基乙酯
10-(2-butoxyethoxy)-10-oxodecanoic acid
Also Known As: Decanedioic acid, 2-butoxyethyl ester, 10-(2-butoxyethoxy)-10-oxodecanoic acid, Sebacic acid, butyl cellosolve reaction product, DECANEDIOIC ACID 2-BUTOXYETHYL ESTER, Decanedioic acid 1-(2-butoxyethyl) ester
| Molecular Formula | C16H30O5 |
|---|---|
| Molecular Weight | 302.21 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 72.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 16 |
| Exact Mass | 302.20932 |
| Heavy Atoms | 21 |
| Complexity | 265.0 |
Chemical Identifiers
| CAS Number | 68186-66-3 |
|---|---|
| SMILES | CCCCOCCOC(=O)CCCCCCCCC(=O)O |
| InChIKey | ZGCXNQBDICMZNA-UHFFFAOYSA-N |
Product Overview
癸二酸-2-丁氧基乙酯 (CAS 68186-66-3), with molecular formula C16H30O5 and molecular weight 302.21 g/mol. IUPAC: 10-(2-butoxyethoxy)-10-oxodecanoic acid.
Chemical Property Profile of 癸二酸-2-丁氧基乙酯
Property Insights of 癸二酸-2-丁氧基乙酯
The XLogP value of 3.5 indicates that 癸二酸-2-丁氧基乙酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 癸二酸-2-丁氧基乙酯. Following Lipinski's Rule of Five, 癸二酸-2-丁氧基乙酯 has 1 hydrogen bond donor(s) and 5 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 癸二酸-2-丁氧基乙酯?
The CAS number of 癸二酸-2-丁氧基乙酯 is 68186-66-3.
What is the molecular formula of 癸二酸-2-丁氧基乙酯?
The molecular formula of 癸二酸-2-丁氧基乙酯 is C16H30O5.
What is the molecular weight of 癸二酸-2-丁氧基乙酯?
The molecular weight of 癸二酸-2-丁氧基乙酯 is 302.21 g/mol.
Where can I buy 癸二酸-2-丁氧基乙酯?
You can request a quote for 癸二酸-2-丁氧基乙酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 癸二酸-2-丁氧基乙酯?
Yes, KEHONG BIO provides custom synthesis services for 癸二酸-2-丁氧基乙酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.