Monopropyl carbonotrithioate
TL;DR: Monopropyl carbonotrithioate (CAS 68060-07-1) is a chemical compound with molecular formula C4H8S3 and molecular weight 151.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propylsulfanylmethanedithioic acid
Also Known As: Monopropyl carbonotrithioate, Monopropylcarbonotrithioate, propyl sulfanylmethanedithioate, Propyl hydrogen trithiocarbonate, propyl hydrogen carbonotrithioate
| Molecular Formula | C4H8S3 |
|---|---|
| Molecular Weight | 151.98 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 58.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 151.97882 |
| Heavy Atoms | 7 |
| Complexity | 60.0 |
Chemical Identifiers
| CAS Number | 68060-07-1 |
|---|---|
| SMILES | CCCSC(=S)S |
| InChIKey | OETRDPZIXKVAQS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Monopropyl carbonotrithioate (CAS 68060-07-1), with molecular formula C4H8S3 and molecular weight 151.98 g/mol. IUPAC: propylsulfanylmethanedithioic acid.
Chemical Property Profile of Monopropyl carbonotrithioate
Property Insights of Monopropyl carbonotrithioate
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Monopropyl carbonotrithioate. With a topological polar surface area (TPSA) of 58.4 Ų, Monopropyl carbonotrithioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Monopropyl carbonotrithioate has 1 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 Monopropyl carbonotrithioate?
The CAS number of Monopropyl carbonotrithioate is 68060-07-1.
What is the molecular formula of Monopropyl carbonotrithioate?
The molecular formula of Monopropyl carbonotrithioate is C4H8S3.
What is the molecular weight of Monopropyl carbonotrithioate?
The molecular weight of Monopropyl carbonotrithioate is 151.98 g/mol.
Where can I buy Monopropyl carbonotrithioate?
You can request a quote for Monopropyl carbonotrithioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Monopropyl carbonotrithioate?
Yes, KEHONG BIO provides custom synthesis services for Monopropyl carbonotrithioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.