4,5-Dichloro-1,3-dioxolan-2-one
TL;DR: 4,5-Dichloro-1,3-dioxolan-2-one (CAS 3967-55-3) is a chemical compound with molecular formula C3H2Cl2O3 and molecular weight 155.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-dichloro-1,3-dioxolan-2-one
Also Known As: 4,5-Dichloro-1,3-dioxolan-2-one, Chloroethylene carbonate, 1,2-Dichloroethylene carbonate, 4,3-dioxolane-2-one, 1, 4,5-dichloro-
| Molecular Formula | C3H2Cl2O3 |
|---|---|
| Molecular Weight | 155.94 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 155.9381 |
| Heavy Atoms | 8 |
| Complexity | 103.0 |
Chemical Identifiers
| CAS Number | 3967-55-3 |
|---|---|
| SMILES | C1(C(OC(=O)O1)Cl)Cl |
| InChIKey | BETICXVUVYXEJX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,5-Dichloro-1,3-dioxolan-2-one (CAS 3967-55-3), with molecular formula C3H2Cl2O3 and molecular weight 155.94 g/mol. IUPAC: 4,5-dichloro-1,3-dioxolan-2-one.
Chemical Property Profile of 4,5-Dichloro-1,3-dioxolan-2-one
Property Insights of 4,5-Dichloro-1,3-dioxolan-2-one
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,5-Dichloro-1,3-dioxolan-2-one. With a topological polar surface area (TPSA) of 35.5 Ų, 4,5-Dichloro-1,3-dioxolan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,5-Dichloro-1,3-dioxolan-2-one 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 4,5-Dichloro-1,3-dioxolan-2-one?
The CAS number of 4,5-Dichloro-1,3-dioxolan-2-one is 3967-55-3.
What is the molecular formula of 4,5-Dichloro-1,3-dioxolan-2-one?
The molecular formula of 4,5-Dichloro-1,3-dioxolan-2-one is C3H2Cl2O3.
What is the molecular weight of 4,5-Dichloro-1,3-dioxolan-2-one?
The molecular weight of 4,5-Dichloro-1,3-dioxolan-2-one is 155.94 g/mol.
Where can I buy 4,5-Dichloro-1,3-dioxolan-2-one?
You can request a quote for 4,5-Dichloro-1,3-dioxolan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5-Dichloro-1,3-dioxolan-2-one?
Yes, KEHONG BIO provides custom synthesis services for 4,5-Dichloro-1,3-dioxolan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.