3-Chloro-1,1-diethoxypropane
TL;DR: 3-Chloro-1,1-diethoxypropane (CAS 35573-93-4) is a chemical compound with molecular formula C7H15ClO2 and molecular weight 166.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-1,1-diethoxypropane
Also Known As: 3-Chloro-1,1-diethoxypropane, 3-Chloropropionaldehyde diethyl acetal, 3-Chloropropionaldehyde diethylacetal, Propane, 3-chloro-1,1-diethoxy-, 3-chloro-1,1-diethoxy-propane
| Molecular Formula | C7H15ClO2 |
|---|---|
| Molecular Weight | 166.08 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 166.07605 |
| Heavy Atoms | 10 |
| Complexity | 62.0 |
Chemical Identifiers
| CAS Number | 35573-93-4 |
|---|---|
| SMILES | CCOC(CCCl)OCC |
| InChIKey | NXHONHDWVLPPCS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Chloro-1,1-diethoxypropane (CAS 35573-93-4), with molecular formula C7H15ClO2 and molecular weight 166.08 g/mol. IUPAC: 3-chloro-1,1-diethoxypropane.
Chemical Property Profile of 3-Chloro-1,1-diethoxypropane
Property Insights of 3-Chloro-1,1-diethoxypropane
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Chloro-1,1-diethoxypropane. With a topological polar surface area (TPSA) of 18.5 Ų, 3-Chloro-1,1-diethoxypropane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Chloro-1,1-diethoxypropane 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 3-Chloro-1,1-diethoxypropane?
The CAS number of 3-Chloro-1,1-diethoxypropane is 35573-93-4.
What is the molecular formula of 3-Chloro-1,1-diethoxypropane?
The molecular formula of 3-Chloro-1,1-diethoxypropane is C7H15ClO2.
What is the molecular weight of 3-Chloro-1,1-diethoxypropane?
The molecular weight of 3-Chloro-1,1-diethoxypropane is 166.08 g/mol.
Where can I buy 3-Chloro-1,1-diethoxypropane?
You can request a quote for 3-Chloro-1,1-diethoxypropane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Chloro-1,1-diethoxypropane?
Yes, KEHONG BIO provides custom synthesis services for 3-Chloro-1,1-diethoxypropane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.