1,3-Dioxolane, 4-methylene-2-(trichloromethyl)-
TL;DR: 1,3-Dioxolane, 4-methylene-2-(trichloromethyl)- (CAS 16042-58-3) is a chemical compound with molecular formula C5H5Cl3O2 and molecular weight 201.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methylidene-2-(trichloromethyl)-1,3-dioxolane
Also Known As: 4-methylidene-2-(trichloromethyl)-1,3-dioxolane, 1,3-Dioxolane, 4-methylene-2-(trichloromethyl)-, 2-trichloromethyl-4-methylene-1,3-dioxolane, RefChem:218958
| Molecular Formula | C5H5Cl3O2 |
|---|---|
| Molecular Weight | 201.94 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 201.93552 |
| Heavy Atoms | 10 |
| Complexity | 151.0 |
Chemical Identifiers
| CAS Number | 16042-58-3 |
|---|---|
| SMILES | C=C1COC(O1)C(Cl)(Cl)Cl |
| InChIKey | DNYTXTXOQMZXOZ-UHFFFAOYSA-N |
Product Overview
1,3-Dioxolane, 4-methylene-2-(trichloromethyl)- (CAS 16042-58-3), with molecular formula C5H5Cl3O2 and molecular weight 201.94 g/mol. IUPAC: 4-methylidene-2-(trichloromethyl)-1,3-dioxolane.
Chemical Property Profile of 1,3-Dioxolane, 4-methylene-2-(trichloromethyl)-
Property Insights of 1,3-Dioxolane, 4-methylene-2-(trichloromethyl)-
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Dioxolane, 4-methylene-2-(trichloromethyl)-. With a topological polar surface area (TPSA) of 18.5 Ų, 1,3-Dioxolane, 4-methylene-2-(trichloromethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dioxolane, 4-methylene-2-(trichloromethyl)- 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 1,3-Dioxolane, 4-methylene-2-(trichloromethyl)-?
The CAS number of 1,3-Dioxolane, 4-methylene-2-(trichloromethyl)- is 16042-58-3.
What is the molecular formula of 1,3-Dioxolane, 4-methylene-2-(trichloromethyl)-?
The molecular formula of 1,3-Dioxolane, 4-methylene-2-(trichloromethyl)- is C5H5Cl3O2.
What is the molecular weight of 1,3-Dioxolane, 4-methylene-2-(trichloromethyl)-?
The molecular weight of 1,3-Dioxolane, 4-methylene-2-(trichloromethyl)- is 201.94 g/mol.
Where can I buy 1,3-Dioxolane, 4-methylene-2-(trichloromethyl)-?
You can request a quote for 1,3-Dioxolane, 4-methylene-2-(trichloromethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dioxolane, 4-methylene-2-(trichloromethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dioxolane, 4-methylene-2-(trichloromethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.