硫酸丁基乙酯
TL;DR: 硫酸丁基乙酯 (CAS 5867-95-8) is a chemical compound with molecular formula C6H14O4S and molecular weight 182.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
硫酸丁基乙酯
butyl ethyl sulfate
Also Known As: Butyl ethyl sulfate, ethyl n-butyl sulfate, Sulfuric acid, butyl ethyl ester, Sulfuric acid butylethyl ester, J1.560.657F
| Molecular Formula | C6H14O4S |
|---|---|
| Molecular Weight | 182.06 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 61.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 182.06128 |
| Heavy Atoms | 11 |
| Complexity | 168.0 |
Chemical Identifiers
| CAS Number | 5867-95-8 |
|---|---|
| SMILES | CCCCOS(=O)(=O)OCC |
| InChIKey | LLJPJAVXLPTAIK-UHFFFAOYSA-N |
Product Overview
硫酸丁基乙酯 (CAS 5867-95-8), with molecular formula C6H14O4S and molecular weight 182.06 g/mol. IUPAC: butyl ethyl sulfate.
Chemical Property Profile of 硫酸丁基乙酯
Property Insights of 硫酸丁基乙酯
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 硫酸丁基乙酯. The TPSA of 61.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 硫酸丁基乙酯. Following Lipinski's Rule of Five, 硫酸丁基乙酯 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 硫酸丁基乙酯?
The CAS number of 硫酸丁基乙酯 is 5867-95-8.
What is the molecular formula of 硫酸丁基乙酯?
The molecular formula of 硫酸丁基乙酯 is C6H14O4S.
What is the molecular weight of 硫酸丁基乙酯?
The molecular weight of 硫酸丁基乙酯 is 182.06 g/mol.
Where can I buy 硫酸丁基乙酯?
You can request a quote for 硫酸丁基乙酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 硫酸丁基乙酯?
Yes, KEHONG BIO provides custom synthesis services for 硫酸丁基乙酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.