(1E)-1-[amino-(4-chloroanilino)methylidene]-2-dodecylguanidine

Base Information

• Chemical Name: (1E)-1-[amino-(4-chloroanilino)methylidene]-2-dodecylguanidine
• CAS No.: 60221-95-6
• Molecular Formula: C20H34ClN5
• Molecular Weight: 379.9705
• ChEMBL ID: CHEMBL3228999
• DSSTox Substance ID: DTXSID80485336
• NSC Number: 333314

Synonyms:SCHEMBL3826641;60221-95-6;CHEMBL3228999;DTXSID80485336;NSC333314;NSC-333314

Chemical Property of (1E)-1-[amino-(4-chloroanilino)methylidene]-2-dodecylguanidine

Chemical Property:

• Vapor Pressure: 1.07E-10mmHg at 25°C
• Boiling Point: 514.5°C at 760 mmHg
• Flash Point: 265°C
• Density: 1.11g/cm³
• XLogP3: 6.3
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 14
• Exact Mass: 379.2502738
• Heavy Atom Count: 26
• Complexity: 403

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCCN=C(N)N=C(N)NC1=CC=C(C=C1)Cl
• Isomeric SMILES: CCCCCCCCCCCCN=C(N)/N=C(\N)/NC1=CC=C(C=C1)Cl

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