Hypochlorous acid, ethyl ester
TL;DR: Hypochlorous acid, ethyl ester (CAS 624-85-1) is a chemical compound with molecular formula CCOCl and molecular weight 80.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl hypochlorite
Also Known As: Ethyl hypochlorite, Hypochlorous acid, ethyl ester, chloro methyl methyl ether, Hypochlorous acid ethyl ester, Hypochlorousacid, ethyl ester (9CI)
| Molecular Formula | CCOCl |
|---|---|
| Molecular Weight | 80.00 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 80.00289 |
| Heavy Atoms | 4 |
| Complexity | 10.0 |
Chemical Identifiers
| CAS Number | 624-85-1 |
|---|---|
| SMILES | CCOCl |
| InChIKey | NSHIYIMHYBAIEY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Hypochlorous acid, ethyl ester (CAS 624-85-1), with molecular formula CCOCl and molecular weight 80.00 g/mol. IUPAC: ethyl hypochlorite.
Chemical Property Profile of Hypochlorous acid, ethyl ester
Property Insights of Hypochlorous acid, ethyl ester
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hypochlorous acid, ethyl ester. With a topological polar surface area (TPSA) of 9.2 Ų, Hypochlorous acid, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hypochlorous acid, ethyl ester has 0 hydrogen bond donor(s) and 1 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 Hypochlorous acid, ethyl ester?
The CAS number of Hypochlorous acid, ethyl ester is 624-85-1.
What is the molecular formula of Hypochlorous acid, ethyl ester?
The molecular formula of Hypochlorous acid, ethyl ester is CCOCl.
What is the molecular weight of Hypochlorous acid, ethyl ester?
The molecular weight of Hypochlorous acid, ethyl ester is 80.00 g/mol.
Where can I buy Hypochlorous acid, ethyl ester?
You can request a quote for Hypochlorous acid, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hypochlorous acid, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Hypochlorous acid, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.