1-phenyl-3-[(E)-[(4E)-4-(phenylcarbamothioylhydrazinylidene)butan-2-ylidene]amino]thiourea

Base Information

• Chemical Name: 1-phenyl-3-[(E)-[(4E)-4-(phenylcarbamothioylhydrazinylidene)butan-2-ylidene]amino]thiourea
• CAS No.: 18667-32-8
• Molecular Formula: C18H20N6S2
• Molecular Weight: 384.5216
• NSC Number: 89233
• DSSTox Substance ID: DTXSID50430636

Synonyms:NSC89233;18667-32-8;DTXSID50430636;NSC-89233

Chemical Property of 1-phenyl-3-[(E)-[(4E)-4-(phenylcarbamothioylhydrazinylidene)butan-2-ylidene]amino]thiourea

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 530.794°C at 760 mmHg
• Flash Point: 274.815°C
• Density: 1.24g/cm³
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 384.11908701
• Heavy Atom Count: 26
• Complexity: 508

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=NNC(=S)NC1=CC=CC=C1)CC=NNC(=S)NC2=CC=CC=C2
• Isomeric SMILES: C/C(=N\NC(=S)NC1=CC=CC=C1)/C/C=N/NC(=S)NC2=CC=CC=C2

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