1-hexadecyl-3-[(E)-[(E)-3-phenylprop-2-enylidene]amino]thiourea

Base Information

• Chemical Name: 1-hexadecyl-3-[(E)-[(E)-3-phenylprop-2-enylidene]amino]thiourea
• CAS No.: 7399-45-3
• Molecular Formula: C26H43N3S
• Molecular Weight: 429.7047
• NSC Number: 54353
• DSSTox Substance ID: DTXSID80430109

Synonyms:NSC54353;7399-45-3;DTXSID80430109;NSC-54353

Chemical Property of 1-hexadecyl-3-[(E)-[(E)-3-phenylprop-2-enylidene]amino]thiourea

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 538.2°Cat760mmHg
• Flash Point: 279.3°C
• Density: 0.96g/cm³
• XLogP3: 9.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 18
• Exact Mass: 429.31776956
• Heavy Atom Count: 30
• Complexity: 442

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCCCCCCNC(=S)NN=CC=CC1=CC=CC=C1
• Isomeric SMILES: CCCCCCCCCCCCCCCCNC(=S)N/N=C/C=C/C1=CC=CC=C1

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