5-(4-Chlorophenyl)-6-methylthieno[2,3-D]pyrimidine-4(3H)-thione

Base Information

• Chemical Name: 5-(4-Chlorophenyl)-6-methylthieno[2,3-D]pyrimidine-4(3H)-thione
• CAS No.: 500198-74-3
• Molecular Formula: C13H9ClN2S2
• Molecular Weight: 292.81
• DSSTox Substance ID: DTXSID00402969
• Wikidata: Q82206500
• Mol file: 500198-74-3.mol

Synonyms:500198-74-3;5-(4-CHLOROPHENYL)-6-METHYLTHIENO[2,3-D]PYRIMIDINE-4(3H)-THIONE;F1174-3242;5-(4-chlorophenyl)-6-methyl-3H-thieno[2,3-d]pyrimidine-4-thione;DTXSID00402969;AKOS000805682;AKOS022236477;EU-0045534;SR-01000497541;SR-01000497541-1;5-(4-chlorophenyl)-6-methyl-3H,4H-thieno[2,3-d]pyrimidine-4-thione

Chemical Property of 5-(4-Chlorophenyl)-6-methylthieno[2,3-D]pyrimidine-4(3H)-thione

Chemical Property:

• Vapor Pressure: 1.51E-07mmHg at 25°C
• Refractive Index: 1.75
• Boiling Point: 428.5°C at 760 mmHg
• Flash Point: 213°C
• PSA: 89.01000
• Density: 1.48g/cm³
• LogP: 4.98270
• XLogP3: 4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 291.9895683
• Heavy Atom Count: 18
• Complexity: 366

Purity/Quality:

99% ^*data from raw suppliers

5-(4-CHLOROPHENYL)-6-METHYLTHIENO(2,3-D)PYRIMIDINE-4(3H)-THIONE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C2=C(S1)N=CNC2=S)C3=CC=C(C=C3)Cl

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