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

Base Information

• Chemical Name: 1-[(E)-(2,3-dimethoxyphenyl)methylideneamino]-3-dodecylthiourea
• CAS No.: 6942-55-8
• Molecular Formula: C22H37N3O2S
• Molecular Weight: 407.6131
• NSC Number: 57224
• DSSTox Substance ID: DTXSID20430123

Synonyms:NSC57224;6942-55-8;DTXSID20430123;NSC-57224

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

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 513.901°C at 760 mmHg
• Flash Point: 264.598°C
• Density: 1.042g/cm³
• XLogP3: 7.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 15
• Exact Mass: 407.26064861
• Heavy Atom Count: 28
• Complexity: 421

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

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

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