CID 5351613

Base Information

• Chemical Name: CID 5351613
• CAS No.: 5339-95-7
• Molecular Formula: C12H14N6O
• Molecular Weight: 258.2792
• NSC Number: 3589
• DSSTox Substance ID: DTXSID70968047
• ChEMBL ID: CHEMBL2001123
• Mol file: 5339-95-7.mol

Synonyms:NSC3589;5339-95-7;NSC-3589;CHEMBL2001123;DTXSID70968047;1-(diaminomethylidene)-2-(6-methoxyquinolin-8-yl)guanidine;hydrochloride;N-(6-Methoxyquinolin-8-yl)triimidodicarbonic diamide--hydrogen chloride (1/1)

Chemical Property of CID 5351613

Chemical Property:

• Vapor Pressure: 6.47E-12mmHg at 25°C
• Boiling Point: 544.5°Cat760mmHg
• Flash Point: 283.1°C
• Density: 1.44g/cm³
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 294.0995868
• Heavy Atom Count: 20
• Complexity: 365

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC(=C2C(=C1)C=CC=N2)N=C(N)N=C(N)N.Cl