3-Amino-1-methyl-5-(propylsulfanyl)-1H-pyrazole-4-carbonitrile

Base Information

• Chemical Name: 3-Amino-1-methyl-5-(propylsulfanyl)-1H-pyrazole-4-carbonitrile
• CAS No.: 512845-55-5
• Molecular Formula: C8H12N4S
• DSSTox Substance ID: DTXSID40451259
• Wikidata: Q82271196
• Mol file: 512845-55-5.mol

Synonyms:512845-55-5;3-Amino-1-methyl-5-(propylthio)-1H-pyrazole-4-carbonitrile;DTXSID40451259;3-Amino-1-methyl-5-(propylsulfanyl)-1H-pyrazole-4-carbonitrile

Chemical Property of 3-Amino-1-methyl-5-(propylsulfanyl)-1H-pyrazole-4-carbonitrile

Chemical Property:

• XLogP3: 1.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 196.07826757
• Heavy Atom Count: 13
• Complexity: 211

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MSDS Files:

Useful:

• Canonical SMILES: CCCSC1=C(C(=NN1C)N)C#N

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