2-Chloro-1,1-dimethoxyethane
TL;DR: 2-Chloro-1,1-dimethoxyethane (CAS 97-97-2) is a chemical compound with molecular formula C4H9ClO2 and molecular weight 124.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-1,1-dimethoxyethane
Also Known As: 2-Chloro-1,1-dimethoxyethane, Chloroacetaldehyde dimethyl acetal, Dimethylchloroacetal, Dimethyl chloroacetal, Dimethyl chloracetal
| Molecular Formula | C4H9ClO2 |
|---|---|
| Molecular Weight | 124.03 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 124.029106 |
| Heavy Atoms | 7 |
| Complexity | 36.0 |
| Boiling Point | 127.5 °C @760 [mm Hg] |
| Density | 1.4150 @ 20°C |
Chemical Identifiers
| CAS Number | 97-97-2 |
|---|---|
| SMILES | COC(CCl)OC |
| InChIKey | CRZJPEIBPQWDGJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Chloro-1,1-dimethoxyethane (CAS 97-97-2), with molecular formula C4H9ClO2 and molecular weight 124.03 g/mol. IUPAC: 2-chloro-1,1-dimethoxyethane.
Chemical Property Profile of 2-Chloro-1,1-dimethoxyethane
Property Insights of 2-Chloro-1,1-dimethoxyethane
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloro-1,1-dimethoxyethane. With a topological polar surface area (TPSA) of 18.5 Ų, 2-Chloro-1,1-dimethoxyethane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-1,1-dimethoxyethane has 0 hydrogen bond donor(s) and 2 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-Chloro-1,1-dimethoxyethane?
The CAS number of 2-Chloro-1,1-dimethoxyethane is 97-97-2.
What is the molecular formula of 2-Chloro-1,1-dimethoxyethane?
The molecular formula of 2-Chloro-1,1-dimethoxyethane is C4H9ClO2.
What is the molecular weight of 2-Chloro-1,1-dimethoxyethane?
The molecular weight of 2-Chloro-1,1-dimethoxyethane is 124.03 g/mol.
Where can I buy 2-Chloro-1,1-dimethoxyethane?
You can request a quote for 2-Chloro-1,1-dimethoxyethane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-1,1-dimethoxyethane?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-1,1-dimethoxyethane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.