2-Butoxyethyl hydrogensulphate
TL;DR: 2-Butoxyethyl hydrogensulphate (CAS 927-96-8) is a chemical compound with molecular formula C6H14O5S and molecular weight 198.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-butoxyethyl hydrogen sulfate
Also Known As: 2-Butoxyethyl hydrogensulphate, 2-butoxyethyl hydrogen sulfate, 2-butoxyethylhydrogensulphate, 2-Butoxyethyl hydrogensulfate, (2-butoxyethoxy)sulfonic acid
| Molecular Formula | C6H14O5S |
|---|---|
| Molecular Weight | 198.06 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 81.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 198.0562 |
| Heavy Atoms | 12 |
| Complexity | 181.0 |
Chemical Identifiers
| CAS Number | 927-96-8 |
|---|---|
| SMILES | CCCCOCCOS(=O)(=O)O |
| InChIKey | XAULISWKJQTUOD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Butoxyethyl hydrogensulphate (CAS 927-96-8), with molecular formula C6H14O5S and molecular weight 198.06 g/mol. IUPAC: 2-butoxyethyl hydrogen sulfate.
Chemical Property Profile of 2-Butoxyethyl hydrogensulphate
Property Insights of 2-Butoxyethyl hydrogensulphate
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Butoxyethyl hydrogensulphate. The TPSA of 81.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Butoxyethyl hydrogensulphate. Following Lipinski's Rule of Five, 2-Butoxyethyl hydrogensulphate 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 2-Butoxyethyl hydrogensulphate?
The CAS number of 2-Butoxyethyl hydrogensulphate is 927-96-8.
What is the molecular formula of 2-Butoxyethyl hydrogensulphate?
The molecular formula of 2-Butoxyethyl hydrogensulphate is C6H14O5S.
What is the molecular weight of 2-Butoxyethyl hydrogensulphate?
The molecular weight of 2-Butoxyethyl hydrogensulphate is 198.06 g/mol.
Where can I buy 2-Butoxyethyl hydrogensulphate?
You can request a quote for 2-Butoxyethyl hydrogensulphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Butoxyethyl hydrogensulphate?
Yes, KEHONG BIO provides custom synthesis services for 2-Butoxyethyl hydrogensulphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.