2-Chloro-1,4-diethoxybenzene
TL;DR: 2-Chloro-1,4-diethoxybenzene (CAS 52196-74-4) is a chemical compound with molecular formula C10H13ClO2 and molecular weight 200.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-1,4-diethoxybenzene
Also Known As: 2-Chloro-1,4-diethoxybenzene, 1-Chloro-2,5-Diethoxybenzene, 2,5-DIETHOXYCHLOROBENZENE, Chloro-2,5-diethoxybenzene, 2,5-Diethoxy-1-chlorobenzene
| Molecular Formula | C10H13ClO2 |
|---|---|
| Molecular Weight | 200.06 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 200.06041 |
| Heavy Atoms | 13 |
| Complexity | 141.0 |
Chemical Identifiers
| CAS Number | 52196-74-4 |
|---|---|
| SMILES | CCOC1=CC(=C(C=C1)OCC)Cl |
| InChIKey | ZIMKMIAIVORSSX-UHFFFAOYSA-N |
Product Overview
2-Chloro-1,4-diethoxybenzene (CAS 52196-74-4), with molecular formula C10H13ClO2 and molecular weight 200.06 g/mol. IUPAC: 2-chloro-1,4-diethoxybenzene.
Chemical Property Profile of 2-Chloro-1,4-diethoxybenzene
Property Insights of 2-Chloro-1,4-diethoxybenzene
The XLogP value of 3.4 indicates that 2-Chloro-1,4-diethoxybenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, 2-Chloro-1,4-diethoxybenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-1,4-diethoxybenzene 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-1,4-diethoxybenzene?
The CAS number of 2-Chloro-1,4-diethoxybenzene is 52196-74-4.
What is the molecular formula of 2-Chloro-1,4-diethoxybenzene?
The molecular formula of 2-Chloro-1,4-diethoxybenzene is C10H13ClO2.
What is the molecular weight of 2-Chloro-1,4-diethoxybenzene?
The molecular weight of 2-Chloro-1,4-diethoxybenzene is 200.06 g/mol.
Where can I buy 2-Chloro-1,4-diethoxybenzene?
You can request a quote for 2-Chloro-1,4-diethoxybenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-1,4-diethoxybenzene?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-1,4-diethoxybenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.