氧代二乙酰二氯
TL;DR: 氧代二乙酰二氯 (CAS 21062-20-4) is a chemical compound with molecular formula C4H4Cl2O3 and molecular weight 169.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
氧代二乙酰二氯
2-(2-chloro-2-oxoethoxy)acetyl chloride
Also Known As: Diglycolyl chloride, 2,2'-Oxydiacetyl chloride, Oxydiacetyl dichloride, Acetyl chloride, 2,2'-oxybis-, 2,2-OXYDIACETYLCHLORIDE
| Molecular Formula | C4H4Cl2O3 |
|---|---|
| Molecular Weight | 169.95 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 169.95375 |
| Heavy Atoms | 9 |
| Complexity | 109.0 |
Chemical Identifiers
| CAS Number | 21062-20-4 |
|---|---|
| SMILES | C(C(=O)Cl)OCC(=O)Cl |
| InChIKey | GTZXSBQCNBNWPK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
氧代二乙酰二氯 (CAS 21062-20-4), with molecular formula C4H4Cl2O3 and molecular weight 169.95 g/mol. IUPAC: 2-(2-chloro-2-oxoethoxy)acetyl chloride.
Chemical Property Profile of 氧代二乙酰二氯
Property Insights of 氧代二乙酰二氯
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 氧代二乙酰二氯. With a topological polar surface area (TPSA) of 43.4 Ų, 氧代二乙酰二氯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 氧代二乙酰二氯 has 0 hydrogen bond donor(s) and 3 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 氧代二乙酰二氯?
The CAS number of 氧代二乙酰二氯 is 21062-20-4.
What is the molecular formula of 氧代二乙酰二氯?
The molecular formula of 氧代二乙酰二氯 is C4H4Cl2O3.
What is the molecular weight of 氧代二乙酰二氯?
The molecular weight of 氧代二乙酰二氯 is 169.95 g/mol.
Where can I buy 氧代二乙酰二氯?
You can request a quote for 氧代二乙酰二氯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 氧代二乙酰二氯?
Yes, KEHONG BIO provides custom synthesis services for 氧代二乙酰二氯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.