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Thiolutin structure
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Thiolutin

TL;DR: Thiolutin (CAS 87-11-6) is a chemical compound with molecular formula C8H8N2O2S2 and molecular weight 228.00272 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

N-(4-methyl-5-oxodithiolo[4,3-b]pyrrol-6-yl)acetamide

Also Known As: Thiolutin, Acetopyrrothin, Acetopyrrothine, Farcinicin, Farcinicine

CAS Number
87-11-6
Molecular Formula
C8H8N2O2S2
Molecular Weight
228.00272 g/mol
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Application Areas

Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (9 patents) Analytical Reagents (2 patents) Biotechnology (67 patents) Catalysts (7 patents) Heterocyclic Building Blocks (45 patents)

Technical Specifications

Molecular FormulaC8H8N2O2S2
Molecular Weight228.00272 g/mol
XLogP-0.6
Topological Polar Surface Area (TPSA)100.0 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors4
Rotatable Bonds1
Exact Mass228.00272 Da
Heavy Atoms14
Complexity387.0
Melting Point273 - 276 °C
Boiling Point152.00 to 156.00 °C. @ 17.00 mm Hg
Solubility0.21 mg/mL
SMILESCC(=O)NC1=C2C(=CSS2)N(C1=O)C
InChIKeyMHMRAFONCSQAIA-UHFFFAOYSA-N

Product Description

Applications: Thiolutin is used in pharmaceutical synthesis routes and API production, as well as biotechnology workflows and life-science research. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

Thiolutin is a pharmaceutical intermediate identified by CAS number 87-11-6 and the molecular formula C8H8N2O2S2 and a molecular weight of 228 g/mol. Physically, the compound has a solubility: 0.21 mg/mL. Synonyms include Thiolutin and Acetopyrrothin.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of Thiolutin

XLogP
-0.6
TPSA (Topological Polar Surface Area)
100.0
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
4
Rotatable Bonds
1
Heavy Atoms
14
Complexity
387.0
Exact Mass
228.00272
Monoisotopic Mass
228.00272
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Thiolutin

The XLogP value of -0.6 indicates that Thiolutin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Thiolutin. Following Lipinski's Rule of Five, Thiolutin has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Thiolutin?

The CAS number of Thiolutin is 87-11-6.

What is the molecular formula of Thiolutin?

The molecular formula of Thiolutin is C8H8N2O2S2.

What is the molecular weight of Thiolutin?

The molecular weight of Thiolutin is 228.00272 g/mol.

What are the applications of Thiolutin?

Thiolutin is used in pharmaceutical synthesis routes and API production, as well as biotechnology workflows and life-science research. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton...

Where can I buy Thiolutin?

You can request a quote for Thiolutin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Thiolutin?

Yes, CoreyChem provides custom synthesis services for Thiolutin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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