1-dodecyl-3-[(E)-(2-nitrophenyl)methylideneamino]thiourea

Base Information

• Chemical Name: 1-dodecyl-3-[(E)-(2-nitrophenyl)methylideneamino]thiourea
• CAS No.: 7356-18-5
• Molecular Formula: C20H32N4O2S
• Molecular Weight: 392.5587
• DSSTox Substance ID: DTXSID50430090
• NSC Number: 51381

Synonyms:NSC51381;7356-18-5;DTXSID50430090;NSC-51381

Chemical Property of 1-dodecyl-3-[(E)-(2-nitrophenyl)methylideneamino]thiourea

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 510.978°C at 760 mmHg
• Flash Point: 262.83°C
• Density: 1.111g/cm³
• XLogP3: 7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 13
• Exact Mass: 392.22459745
• Heavy Atom Count: 27
• Complexity: 440

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCCNC(=S)NN=CC1=CC=CC=C1[N+](=O)[O-]
• Isomeric SMILES: CCCCCCCCCCCCNC(=S)N/N=C/C1=CC=CC=C1[N+](=O)[O-]

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