2-(Acetyloxy)-1,2-dichloroethyl acetate
TL;DR: 2-(Acetyloxy)-1,2-dichloroethyl acetate (CAS 59602-17-4) is a chemical compound with molecular formula C6H8Cl2O4 and molecular weight 213.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-acetyloxy-1,2-dichloroethyl) acetate
Also Known As: 2-(Acetyloxy)-1,2-dichloroethyl acetate, 2-1,2-dichloroethylacetate, 2- -1,2-dichloroethylacetate, 1,2-diacetoxy-1,2-dichloro-ethane, (2-acetyloxy-1,2-dichloroethyl) acetate
| Molecular Formula | C6H8Cl2O4 |
|---|---|
| Molecular Weight | 213.98 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 213.97997 |
| Heavy Atoms | 12 |
| Complexity | 162.0 |
Chemical Identifiers
| CAS Number | 59602-17-4 |
|---|---|
| SMILES | CC(=O)OC(C(OC(=O)C)Cl)Cl |
| InChIKey | IKRUPSGLJUNOCS-UHFFFAOYSA-N |
Product Overview
2-(Acetyloxy)-1,2-dichloroethyl acetate (CAS 59602-17-4), with molecular formula C6H8Cl2O4 and molecular weight 213.98 g/mol. IUPAC: (2-acetyloxy-1,2-dichloroethyl) acetate.
Chemical Property Profile of 2-(Acetyloxy)-1,2-dichloroethyl acetate
Property Insights of 2-(Acetyloxy)-1,2-dichloroethyl acetate
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Acetyloxy)-1,2-dichloroethyl acetate. With a topological polar surface area (TPSA) of 52.6 Ų, 2-(Acetyloxy)-1,2-dichloroethyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Acetyloxy)-1,2-dichloroethyl acetate 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 2-(Acetyloxy)-1,2-dichloroethyl acetate?
The CAS number of 2-(Acetyloxy)-1,2-dichloroethyl acetate is 59602-17-4.
What is the molecular formula of 2-(Acetyloxy)-1,2-dichloroethyl acetate?
The molecular formula of 2-(Acetyloxy)-1,2-dichloroethyl acetate is C6H8Cl2O4.
What is the molecular weight of 2-(Acetyloxy)-1,2-dichloroethyl acetate?
The molecular weight of 2-(Acetyloxy)-1,2-dichloroethyl acetate is 213.98 g/mol.
Where can I buy 2-(Acetyloxy)-1,2-dichloroethyl acetate?
You can request a quote for 2-(Acetyloxy)-1,2-dichloroethyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Acetyloxy)-1,2-dichloroethyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 2-(Acetyloxy)-1,2-dichloroethyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.