2-Chloroethyl hydrogen sulfate
TL;DR: 2-Chloroethyl hydrogen sulfate (CAS 65655-88-1) is a chemical compound with molecular formula C2H5ClO4S and molecular weight 159.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloroethyl hydrogen sulfate
Also Known As: 2-chloroethyl hydrogen sulfate, NCIOpen2_000873, Sulfuric acid mono-(2-chloro-ethyl) ester, C2H5ClO4S
| Molecular Formula | C2H5ClO4S |
|---|---|
| Molecular Weight | 159.96 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 72.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 159.9597 |
| Heavy Atoms | 8 |
| Complexity | 133.0 |
Chemical Identifiers
| CAS Number | 65655-88-1 |
|---|---|
| SMILES | C(CCl)OS(=O)(=O)O |
| InChIKey | KKMZBTDWXHJLOW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Chloroethyl hydrogen sulfate (CAS 65655-88-1), with molecular formula C2H5ClO4S and molecular weight 159.96 g/mol. IUPAC: 2-chloroethyl hydrogen sulfate.
Chemical Property Profile of 2-Chloroethyl hydrogen sulfate
Property Insights of 2-Chloroethyl hydrogen sulfate
The XLogP value of -0.3 indicates that 2-Chloroethyl hydrogen sulfate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 72.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Chloroethyl hydrogen sulfate. Following Lipinski's Rule of Five, 2-Chloroethyl hydrogen sulfate has 1 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-Chloroethyl hydrogen sulfate?
The CAS number of 2-Chloroethyl hydrogen sulfate is 65655-88-1.
What is the molecular formula of 2-Chloroethyl hydrogen sulfate?
The molecular formula of 2-Chloroethyl hydrogen sulfate is C2H5ClO4S.
What is the molecular weight of 2-Chloroethyl hydrogen sulfate?
The molecular weight of 2-Chloroethyl hydrogen sulfate is 159.96 g/mol.
Where can I buy 2-Chloroethyl hydrogen sulfate?
You can request a quote for 2-Chloroethyl hydrogen sulfate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloroethyl hydrogen sulfate?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloroethyl hydrogen sulfate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.