1-(5-Chloro-2,4-dimethoxyphenyl)-3-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)thiourea

Base Information

• Chemical Name: 1-(5-Chloro-2,4-dimethoxyphenyl)-3-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)thiourea
• CAS No.: 61600-69-9
• Molecular Formula: C18H18ClN3O2S2
• Molecular Weight: 407.9374
• NSC Number: 241650
• DSSTox Substance ID: DTXSID10398723

Synonyms:61600-69-9;NSC241650;DTXSID10398723;NSC-241650;1-(5-chloro-2,4-dimethoxyphenyl)-3-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)thiourea

Chemical Property of 1-(5-Chloro-2,4-dimethoxyphenyl)-3-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)thiourea

Chemical Property:

• Vapor Pressure: 4.64E-13mmHg at 25°C
• Boiling Point: 571.2°Cat760mmHg
• Flash Point: 299.3°C
• Density: 1.42g/cm³
• XLogP3: 5.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 407.0528969
• Heavy Atom Count: 26
• Complexity: 558

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC(=C(C=C1NC(=S)NC2=C(C3=C(S2)CCCC3)C#N)Cl)OC

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