![2-[1-(Acetyloxy)-2-chloroethyl]-5-(chloromethyl)-1,3-dioxolan-4-yl acetate structure](/static/products/6807/68076-11-9.webp)
2-[1-(Acetyloxy)-2-chloroethyl]-5-(chloromethyl)-1,3-dioxolan-4-yl acetate
TL;DR: 2-[1-(Acetyloxy)-2-chloroethyl]-5-(chloromethyl)-1,3-dioxolan-4-yl acetate (CAS 68076-11-9) is a chemical compound with molecular formula C10H14Cl2O6 and molecular weight 300.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(1-acetyloxy-2-chloroethyl)-5-(chloromethyl)-1,3-dioxolan-4-yl] acetate
Also Known As: [2-(1-acetyloxy-2-chloroethyl)-5-(chloromethyl)-1,3-dioxolan|2-[1-(Acetyloxy)-2-chloroethyl]-5-(chloromethyl)-1,3-dioxolan-4-yl acetate|[2-(1-acetyloxy-2-chloro-ethyl)-5-(chloromethyl)-1,3-dioxolan-4-yl] acetate|[2-(1-acetyloxy-2-chloroethyl)-5-(chloromethyl)-1,3-dioxolan-4-yl] acetate
| Molecular Formula | C10H14Cl2O6 |
|---|---|
| Molecular Weight | 300.02 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 71.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 300.01675 |
| Heavy Atoms | 18 |
| Complexity | 311.0 |
Chemical Identifiers
| CAS Number | 68076-11-9 |
|---|---|
| SMILES | CC(=O)OC1C(OC(O1)C(CCl)OC(=O)C)CCl |
| InChIKey | BLZXMCXBHWNSOL-UHFFFAOYSA-N |
Product Overview
2-[1-(Acetyloxy)-2-chloroethyl]-5-(chloromethyl)-1,3-dioxolan-4-yl acetate (CAS 68076-11-9), with molecular formula C10H14Cl2O6 and molecular weight 300.02 g/mol. IUPAC: [2-(1-acetyloxy-2-chloroethyl)-5-(chloromethyl)-1,3-dioxolan-4-yl] acetate.
Chemical Property Profile of 2-[1-(Acetyloxy)-2-chloroethyl]-5-(chloromethyl)-1,3-dioxolan-4-yl acetate
Property Insights of 2-[1-(Acetyloxy)-2-chloroethyl]-5-(chloromethyl)-1,3-dioxolan-4-yl acetate
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[1-(Acetyloxy)-2-chloroethyl]-5-(chloromethyl)-1,3-dioxolan-4-yl acetate. The TPSA of 71.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[1-(Acetyloxy)-2-chloroethyl]-5-(chloromethyl)-1,3-dioxolan-4-yl acetate. Following Lipinski's Rule of Five, 2-[1-(Acetyloxy)-2-chloroethyl]-5-(chloromethyl)-1,3-dioxolan-4-yl acetate has 0 hydrogen bond donor(s) and 6 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-[1-(Acetyloxy)-2-chloroethyl]-5-(chloromethyl)-1,3-dioxolan-4-yl acetate?
The CAS number of 2-[1-(Acetyloxy)-2-chloroethyl]-5-(chloromethyl)-1,3-dioxolan-4-yl acetate is 68076-11-9.
What is the molecular formula of 2-[1-(Acetyloxy)-2-chloroethyl]-5-(chloromethyl)-1,3-dioxolan-4-yl acetate?
The molecular formula of 2-[1-(Acetyloxy)-2-chloroethyl]-5-(chloromethyl)-1,3-dioxolan-4-yl acetate is C10H14Cl2O6.
What is the molecular weight of 2-[1-(Acetyloxy)-2-chloroethyl]-5-(chloromethyl)-1,3-dioxolan-4-yl acetate?
The molecular weight of 2-[1-(Acetyloxy)-2-chloroethyl]-5-(chloromethyl)-1,3-dioxolan-4-yl acetate is 300.02 g/mol.
Where can I buy 2-[1-(Acetyloxy)-2-chloroethyl]-5-(chloromethyl)-1,3-dioxolan-4-yl acetate?
You can request a quote for 2-[1-(Acetyloxy)-2-chloroethyl]-5-(chloromethyl)-1,3-dioxolan-4-yl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[1-(Acetyloxy)-2-chloroethyl]-5-(chloromethyl)-1,3-dioxolan-4-yl acetate?
Yes, KEHONG BIO provides custom synthesis services for 2-[1-(Acetyloxy)-2-chloroethyl]-5-(chloromethyl)-1,3-dioxolan-4-yl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.