2-Furancarbodithioic acid, propyl ester
TL;DR: 2-Furancarbodithioic acid, propyl ester (CAS 27249-80-5) is a chemical compound with molecular formula C8H10OS2 and molecular weight 186.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propyl furan-2-carbodithioate
Also Known As: propyl furan-2-carbodithioate, Propyl 2-furancarbodithioate #, 2-Furancarbodithioic acid, propyl ester, 2-Furoic acid, dithio-, propyl ester, 2-Furandithiocarboxylic acid propyl ester
| Molecular Formula | C8H10OS2 |
|---|---|
| Molecular Weight | 186.02 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 70.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 186.0173 |
| Heavy Atoms | 11 |
| Complexity | 136.0 |
Chemical Identifiers
| CAS Number | 27249-80-5 |
|---|---|
| SMILES | CCCSC(=S)C1=CC=CO1 |
| InChIKey | MNPSCQXZMXLSSN-UHFFFAOYSA-N |
Product Overview
2-Furancarbodithioic acid, propyl ester (CAS 27249-80-5), with molecular formula C8H10OS2 and molecular weight 186.02 g/mol. IUPAC: propyl furan-2-carbodithioate.
Chemical Property Profile of 2-Furancarbodithioic acid, propyl ester
Property Insights of 2-Furancarbodithioic acid, propyl ester
The XLogP value of 3.2 indicates that 2-Furancarbodithioic acid, propyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Furancarbodithioic acid, propyl ester. Following Lipinski's Rule of Five, 2-Furancarbodithioic acid, propyl ester 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 2-Furancarbodithioic acid, propyl ester?
The CAS number of 2-Furancarbodithioic acid, propyl ester is 27249-80-5.
What is the molecular formula of 2-Furancarbodithioic acid, propyl ester?
The molecular formula of 2-Furancarbodithioic acid, propyl ester is C8H10OS2.
What is the molecular weight of 2-Furancarbodithioic acid, propyl ester?
The molecular weight of 2-Furancarbodithioic acid, propyl ester is 186.02 g/mol.
Where can I buy 2-Furancarbodithioic acid, propyl ester?
You can request a quote for 2-Furancarbodithioic acid, propyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Furancarbodithioic acid, propyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2-Furancarbodithioic acid, propyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.