1,3-Dioxolane, 2,2-dimethyl-4-((pentachlorophenylthio)methyl)-
TL;DR: 1,3-Dioxolane, 2,2-dimethyl-4-((pentachlorophenylthio)methyl)- (CAS 73987-11-8) is a chemical compound with molecular formula C12H11Cl5O2S and molecular weight 393.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dimethyl-4-[(2,3,4,5,6-pentachlorophenyl)sulfanylmethyl]-1,3-dioxolane
Also Known As: 3-Pentachlorophenylthio-1,2-propanediol acetonide, 2,2-Dimethyl-4-((pentachlorophenylthio)methyl)-1,3-dioxolane, 6(2H)-Quinolinone,octahydro-1-methyl-,trans, 1,3-DIOXOLANE, 2,2-DIMETHYL-4-((PENTACHLOROPHENYLTHIO)METHYL)-, 2,2-dimethyl-4-[(2,3,4,5,6-pentachlorophenyl)sulfanylmethyl]-1,3-dioxolane
| Molecular Formula | C12H11Cl5O2S |
|---|---|
| Molecular Weight | 393.89 g/mol |
| LogP | 5.8 |
| Topological Polar Surface Area | 43.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 395.88928 |
| Heavy Atoms | 20 |
| Complexity | 330.0 |
Chemical Identifiers
| CAS Number | 73987-11-8 |
|---|---|
| SMILES | CC1(OCC(O1)CSC2=C(C(=C(C(=C2Cl)Cl)Cl)Cl)Cl)C |
| InChIKey | DVLUIQKNFOKCIV-UHFFFAOYSA-N |
Product Overview
1,3-Dioxolane, 2,2-dimethyl-4-((pentachlorophenylthio)methyl)- (CAS 73987-11-8), with molecular formula C12H11Cl5O2S and molecular weight 393.89 g/mol. IUPAC: 2,2-dimethyl-4-[(2,3,4,5,6-pentachlorophenyl)sulfanylmethyl]-1,3-dioxolane.
Chemical Property Profile of 1,3-Dioxolane, 2,2-dimethyl-4-((pentachlorophenylthio)methyl)-
Property Insights of 1,3-Dioxolane, 2,2-dimethyl-4-((pentachlorophenylthio)methyl)-
The XLogP value of 5.8 indicates that 1,3-Dioxolane, 2,2-dimethyl-4-((pentachlorophenylthio)methyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.8 Ų, 1,3-Dioxolane, 2,2-dimethyl-4-((pentachlorophenylthio)methyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dioxolane, 2,2-dimethyl-4-((pentachlorophenylthio)methyl)- has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,3-Dioxolane, 2,2-dimethyl-4-((pentachlorophenylthio)methyl)-?
The CAS number of 1,3-Dioxolane, 2,2-dimethyl-4-((pentachlorophenylthio)methyl)- is 73987-11-8.
What is the molecular formula of 1,3-Dioxolane, 2,2-dimethyl-4-((pentachlorophenylthio)methyl)-?
The molecular formula of 1,3-Dioxolane, 2,2-dimethyl-4-((pentachlorophenylthio)methyl)- is C12H11Cl5O2S.
What is the molecular weight of 1,3-Dioxolane, 2,2-dimethyl-4-((pentachlorophenylthio)methyl)-?
The molecular weight of 1,3-Dioxolane, 2,2-dimethyl-4-((pentachlorophenylthio)methyl)- is 393.89 g/mol.
Where can I buy 1,3-Dioxolane, 2,2-dimethyl-4-((pentachlorophenylthio)methyl)-?
You can request a quote for 1,3-Dioxolane, 2,2-dimethyl-4-((pentachlorophenylthio)methyl)- 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, 2,2-dimethyl-4-((pentachlorophenylthio)methyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dioxolane, 2,2-dimethyl-4-((pentachlorophenylthio)methyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.