1H-Pyrazole-3-carboxylic acid, 1-[[(4-amino-5-methyl-4H-1,2,4-triazol-3-yl)thio]methyl]-, methyl ester
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1H-Pyrazole-3-carboxylic acid, 1-[[(4-amino-5-methyl-4H-1,2,4-triazol-3-yl)thio]methyl]-, methyl ester
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CAS No:
956392-66-8
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Formula:
C9H12N6O2S
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Chemical Name:
1H-Pyrazole-3-carboxylic acid, 1-[[(4-amino-5-methyl-4H-1,2,4-triazol-3-yl)thio]methyl]-, methyl ester
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CAS No:
1H-Pyrazole-3-carboxylic acid, 1-[[(4-amino-5-methyl-4H-1,2,4-triazol-3-yl)thio]methyl]-, methyl ester Basic Attributes
268.29600
268.07424482
Computed Properties
Molecular Weight:268.30
XLogP3:0.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:268.07424482
Monoisotopic Mass:268.07424482
Topological Polar Surface Area:126
Heavy Atom Count:18
Complexity:307
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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