5H-(1)Benzothieno(3,2-d)-1,3,4-thiadiazolo(3,2-a)pyrimidin-5-one, 2-(methylthio)-

Base Information

• Chemical Name: 5H-(1)Benzothieno(3,2-d)-1,3,4-thiadiazolo(3,2-a)pyrimidin-5-one, 2-(methylthio)-
• CAS No.: 110543-83-4
• Molecular Formula: C12H7 N3 O S3
• Molecular Weight: 305.3985
• DSSTox Substance ID: DTXSID20149288
• Wikidata: Q83015029
• Mol file: 110543-83-4.mol

Synonyms:2-(Methylthio)-5H-(1)benzothieno(3,2-d)-1,3,4-thiadiazolo(3,2-a)pyrimidin-5-one;5H-(1)Benzothieno(3,2-d)-1,3,4-thiadiazolo(3,2-a)pyrimidin-5-one, 2-(methylthio)-;110543-83-4;C12H7N3OS3;DTXSID20149288;LS-41076

Chemical Property of 5H-(1)Benzothieno(3,2-d)-1,3,4-thiadiazolo(3,2-a)pyrimidin-5-one, 2-(methylthio)-

Chemical Property:

• Vapor Pressure: 7.35E-11mmHg at 25°C
• Boiling Point: 518.6°Cat760mmHg
• Flash Point: 267.5°C
• Density: 1.77g/cm³
• XLogP3: 3.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 1
• Exact Mass: 304.97512538
• Heavy Atom Count: 19
• Complexity: 493

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CSC1=NN2C(=O)C3=C(C4=CC=CC=C4S3)N=C2S1

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