1-[(E)-(2,3-dimethoxyphenyl)methylideneamino]-3-hexadecylthiourea

Base Information

• Chemical Name: 1-[(E)-(2,3-dimethoxyphenyl)methylideneamino]-3-hexadecylthiourea
• CAS No.: 6277-21-0
• Molecular Formula: C26H45N3O2S
• Molecular Weight: 463.7194
• NSC Number: 35337
• DSSTox Substance ID: DTXSID60430041

Synonyms:NSC35337;6277-21-0;DTXSID60430041;NSC-35337

Chemical Property of 1-[(E)-(2,3-dimethoxyphenyl)methylideneamino]-3-hexadecylthiourea

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 560°Cat760mmHg
• Flash Point: 292.5°C
• Density: 1.01g/cm³
• XLogP3: 9.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 19
• Exact Mass: 463.32324886
• Heavy Atom Count: 32
• Complexity: 476

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

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

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