4-(Chloromethyl)-2-(4-methoxyphenyl)-1,3-dioxolane
TL;DR: 4-(Chloromethyl)-2-(4-methoxyphenyl)-1,3-dioxolane (CAS 4469-48-1) is a chemical compound with molecular formula C11H13ClO3 and molecular weight 228.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(chloromethyl)-2-(4-methoxyphenyl)-1,3-dioxolane
Also Known As: 4-(chloromethyl)-2-(4-methoxyphenyl)-1,3-dioxolane, anisyl-2 chloromethyl-4 dioxolanne-1,3, J2.638.423K, 2-(4-Methoxyphenyl)-4-(chloromethyl)-1,3-dioxolane, 1,3-Dioxolane,4-(chloromethyl)-2-(4-methoxyphenyl)-
| Molecular Formula | C11H13ClO3 |
|---|---|
| Molecular Weight | 228.06 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 228.05533 |
| Heavy Atoms | 15 |
| Complexity | 192.0 |
Chemical Identifiers
| CAS Number | 4469-48-1 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2OCC(O2)CCl |
| InChIKey | ZHOGESWPZCQJQH-UHFFFAOYSA-N |
Product Overview
4-(Chloromethyl)-2-(4-methoxyphenyl)-1,3-dioxolane (CAS 4469-48-1), with molecular formula C11H13ClO3 and molecular weight 228.06 g/mol. IUPAC: 4-(chloromethyl)-2-(4-methoxyphenyl)-1,3-dioxolane.
Chemical Property Profile of 4-(Chloromethyl)-2-(4-methoxyphenyl)-1,3-dioxolane
Property Insights of 4-(Chloromethyl)-2-(4-methoxyphenyl)-1,3-dioxolane
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Chloromethyl)-2-(4-methoxyphenyl)-1,3-dioxolane. With a topological polar surface area (TPSA) of 27.7 Ų, 4-(Chloromethyl)-2-(4-methoxyphenyl)-1,3-dioxolane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Chloromethyl)-2-(4-methoxyphenyl)-1,3-dioxolane 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 4-(Chloromethyl)-2-(4-methoxyphenyl)-1,3-dioxolane?
The CAS number of 4-(Chloromethyl)-2-(4-methoxyphenyl)-1,3-dioxolane is 4469-48-1.
What is the molecular formula of 4-(Chloromethyl)-2-(4-methoxyphenyl)-1,3-dioxolane?
The molecular formula of 4-(Chloromethyl)-2-(4-methoxyphenyl)-1,3-dioxolane is C11H13ClO3.
What is the molecular weight of 4-(Chloromethyl)-2-(4-methoxyphenyl)-1,3-dioxolane?
The molecular weight of 4-(Chloromethyl)-2-(4-methoxyphenyl)-1,3-dioxolane is 228.06 g/mol.
Where can I buy 4-(Chloromethyl)-2-(4-methoxyphenyl)-1,3-dioxolane?
You can request a quote for 4-(Chloromethyl)-2-(4-methoxyphenyl)-1,3-dioxolane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Chloromethyl)-2-(4-methoxyphenyl)-1,3-dioxolane?
Yes, KEHONG BIO provides custom synthesis services for 4-(Chloromethyl)-2-(4-methoxyphenyl)-1,3-dioxolane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.