1-methyl-3-[(Z)-[(2E)-2-(methylcarbamothioylhydrazinylidene)-1-(4-methylphenyl)ethylidene]amino]thiourea

Base Information

• Chemical Name: 1-methyl-3-[(Z)-[(2E)-2-(methylcarbamothioylhydrazinylidene)-1-(4-methylphenyl)ethylidene]amino]thiourea
• CAS No.: 57547-41-8
• Molecular Formula: C13H18N6S2
• Molecular Weight: 322.4522
• NSC Number: 186276
• DSSTox Substance ID: DTXSID90430337

Synonyms:NSC186276;57547-41-8;DTXSID90430337;NSC-186276;Hydrazinecarbothioamide,2'-[1-(4-methylphenyl)-1,2-ethanediylidene]bis[N-methyl-

Chemical Property of 1-methyl-3-[(Z)-[(2E)-2-(methylcarbamothioylhydrazinylidene)-1-(4-methylphenyl)ethylidene]amino]thiourea

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 444.2°Cat760mmHg
• Flash Point: 222.5°C
• Density: 1.25g/cm³
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 322.10343695
• Heavy Atom Count: 21
• Complexity: 413

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)C(=NNC(=S)NC)C=NNC(=S)NC
• Isomeric SMILES: CC1=CC=C(C=C1)/C(=N/NC(=S)NC)/C=N/NC(=S)NC

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