300557-77-1

Basic information

• Product Name: 3-PHENYL-2-SULFANYL-3,5,6,7-TETRAHYDRO-4H-CYCLOPENTA[4,5]THIENO[2,3-D]PYRIMIDIN-4-ONE
• Synonyms: 3-PHENYL-2-SULFANYL-3,5,6,7-TETRAHYDRO-4H-CYCLOPENTA[4,5]THIENO[2,3-D]PYRIMIDIN-4-ONE;4H-CYCLOPENTA[4,5]THIENO[2,3-D]PYRIMIDIN-4-ONE, 3,5,6,7-TETRAHYDRO-2-MERCAPTO-3-PHENYL-;6-MERCAPTO-5-PHENYL-1,2,3,5-TETRAHYDRO-8-THIA-5,7-DIAZA-CYCLOPENTA[A]INDEN-4-ONE;2-Mercapto-3-phenyl-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyriMidin-4-one, 96%;2-Mercapto-3-phenyl-3,5,6,7-tetrahydro-4H-cyclopenta[b]thieno[2,3-d]pyriMidin-4-one, 96%;AE-848/36199054;BAS 00435712;BIM-0017959.P001
• CAS NO: 300557-77-1
• Molecular Formula: C₁₅H₁₂N₂OS₂
• Molecular Weight: 300.4
• Mol File: 300557-77-1.mol
• Article Data: 1

Chemical Properties

• Melting Point: >250℃
• Boiling Point: 505.9°C at 760 mmHg
• Flash Point: 259.8°C
• Appearance: /
• Density: 1.5g/cm³
• Vapor Pressure: 2.33E-10mmHg at 25°C
• Refractive Index: 1.774
• CAS DataBase Reference: 3-PHENYL-2-SULFANYL-3,5,6,7-TETRAHYDRO-4H-CYCLOPENTA[4,5]THIENO[2,3-D]PYRIMIDIN-4-ONE(CAS DataBase Reference)
• NIST Chemistry Reference: 3-PHENYL-2-SULFANYL-3,5,6,7-TETRAHYDRO-4H-CYCLOPENTA[4,5]THIENO[2,3-D]PYRIMIDIN-4-ONE(300557-77-1)
• EPA Substance Registry System: 3-PHENYL-2-SULFANYL-3,5,6,7-TETRAHYDRO-4H-CYCLOPENTA[4,5]THIENO[2,3-D]PYRIMIDIN-4-ONE(300557-77-1)

Safety Data

• Hazardous Substances Data: 300557-77-1(Hazardous Substances Data)

Usage

InChI:InChI=1/C15H12N2OS2/c18-14-12-10-7-4-8-11(10)20-13(12)16-15(19)17(14)9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H,16,19)

Upstream product

• 59898-49-6 ethyl 2-(3-phenylthioureido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate 
• 120-92-3 cyclopentanone 
• 4815-29-6 ethyl 2-amino-4H,5H,6H-cyclopentenothiophene-3-carboxylate 

Downstream Products

• 314042-08-5 3-phenyl-2-(prop-2-yn-1-ylsulfanyl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one 
• 512186-82-2 (1E)-1-(bromomethylidene)-5-oxo-4-phenyl-1,2,4,6,7,8-hexahydro-5H-cyclopenta-[4,5]thieno[3,2-e][1,3]thiazolo[3,2-a]pyrimidin-10-ium bromide 

Relevant articles and documents

Synthesis of novel substituted 2-lactosylthiothieno[2,3-d]pyrimidin-4(3H)-one derivatives

The title compounds substituted 2-lactosylthiothieno[2,3-d]pyrimidin-4-ones 6 were synthesized by the glycosyl reaction and alcoholysis reaction of substituted 2-thioxo-thieno[2,3-d]pyrimidin-4-ones 4,which is formed by the base catalytic and acetic acidify reaction of amino esters 2 with alkyl or arylisothiocyanates and hepta-O-acetyl-lactosyl bromide in good yields. All of the compounds were confirmed by NMR, ESI-MS, and elemental analysis.