1H-Pyrazole-4-carbonitrile, 3-amino-5-[(phenylmethyl)thio]-

Base Information

• Chemical Name: 1H-Pyrazole-4-carbonitrile, 3-amino-5-[(phenylmethyl)thio]-
• CAS No.: 133863-83-9
• Molecular Formula: C11H10N4S
• DSSTox Substance ID: DTXSID10364807
• Nikkaji Number: J570.429D
• Wikidata: Q82148968
• Mol file: 133863-83-9.mol

Synonyms:133863-83-9;3-Amino-5-(benzylthio)-1H-pyrazole-4-carbonitrile;1H-Pyrazole-4-carbonitrile, 3-amino-5-[(phenylmethyl)thio]-;SCHEMBL9760986;DTXSID10364807;3-amino-5-benzylthio-4-cyanopyrazole;5-Amino-3-benzylthio-1H-pyrazole-4-carbonitrile

Chemical Property of 1H-Pyrazole-4-carbonitrile, 3-amino-5-[(phenylmethyl)thio]-

Chemical Property:

• XLogP3: 2.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 230.06261751
• Heavy Atom Count: 16
• Complexity: 268

Purity/Quality:

98%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)CSC2=NNC(=C2C#N)N

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