Carbonic acid, dithio-, anhydrosulfide with thio-2-furoic acid, O-hexyl ester
TL;DR: Carbonic acid, dithio-, anhydrosulfide with thio-2-furoic acid, O-hexyl ester (CAS 105770-08-9) is a chemical compound with molecular formula C12H16O3S2 and molecular weight 272.05408 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
O-hexyl furan-2-carbonylsulfanylmethanethioate
Also Known As: Carbonic acid, dithio-, anhydrosulfide with thio-2-furoic acid, O-hexyl ester, O-hexyl furan-2-carbonylsulfanylmethanethioate, S-(Furan-2-carbonyl) O-hexyl carbonodithioate, 2-Furancarbothioic acid, anhydrosulfide with O-hexyl hydrogen carbonodithioate
Technical Specifications
| Molecular Formula | C12H16O3S2 |
| Molecular Weight | 272.05408 g/mol |
| XLogP | 4.8 |
| Topological Polar Surface Area (TPSA) | 96.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 272.05408 Da |
| Heavy Atoms | 17 |
| Complexity | 256.0 |
| SMILES | CCCCCCOC(=S)SC(=O)C1=CC=CO1 |
| InChIKey | LBPZWBIDFFVKNN-UHFFFAOYSA-N |
Chemical Property Profile of Carbonic acid, dithio-, anhydrosulfide with thio-2-furoic acid, O-hexyl ester
Property Insights of Carbonic acid, dithio-, anhydrosulfide with thio-2-furoic acid, O-hexyl ester
The XLogP value of 4.8 indicates that Carbonic acid, dithio-, anhydrosulfide with thio-2-furoic acid, O-hexyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbonic acid, dithio-, anhydrosulfide with thio-2-furoic acid, O-hexyl ester. Following Lipinski's Rule of Five, Carbonic acid, dithio-, anhydrosulfide with thio-2-furoic acid, O-hexyl ester has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Carbonic acid, dithio-, anhydrosulfide with thio-2-furoic acid, O-hexyl ester?
The CAS number of Carbonic acid, dithio-, anhydrosulfide with thio-2-furoic acid, O-hexyl ester is 105770-08-9.
What is the molecular formula of Carbonic acid, dithio-, anhydrosulfide with thio-2-furoic acid, O-hexyl ester?
The molecular formula of Carbonic acid, dithio-, anhydrosulfide with thio-2-furoic acid, O-hexyl ester is C12H16O3S2.
What is the molecular weight of Carbonic acid, dithio-, anhydrosulfide with thio-2-furoic acid, O-hexyl ester?
The molecular weight of Carbonic acid, dithio-, anhydrosulfide with thio-2-furoic acid, O-hexyl ester is 272.05408 g/mol.
Where can I buy Carbonic acid, dithio-, anhydrosulfide with thio-2-furoic acid, O-hexyl ester?
You can request a quote for Carbonic acid, dithio-, anhydrosulfide with thio-2-furoic acid, O-hexyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Carbonic acid, dithio-, anhydrosulfide with thio-2-furoic acid, O-hexyl ester?
Yes, CoreyChem provides custom synthesis services for Carbonic acid, dithio-, anhydrosulfide with thio-2-furoic acid, O-hexyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.