1-(4-Amino-1,2,5-oxadiazol-3-yl)-5-tert-butyl-1H-1,2,3-triazole-4-carboxylic acid
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1-(4-Amino-1,2,5-oxadiazol-3-yl)-5-tert-butyl-1H-1,2,3-triazole-4-carboxylic acid
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CAS No:
898740-04-0
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Formula:
C9H12N6O3
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Chemical Name:
1-(4-Amino-1,2,5-oxadiazol-3-yl)-5-tert-butyl-1H-1,2,3-triazole-4-carboxylic acid
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Synonyms:
1-(4-AMINO-1,2,5-OXADIAZOL-3-YL)-5-TERT-BUTYL-1H-1,2,3-TRIAZOLE-4-CARBOXYLIC ACID;SCHEMBL18169189;CTK7J1182;ZINC6882832;1-(4-amino-1,2,5-oxadiazol-3-yl)-5-tert-butyltriazole-4-carboxylic acid;AKOS015854616
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CAS No:
1-(4-Amino-1,2,5-oxadiazol-3-yl)-5-tert-butyl-1H-1,2,3-triazole-4-carboxylic acid Basic Attributes
252.22998
252.097
Computed Properties
Molecular Weight:252.23
XLogP3:0.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:3
Exact Mass:252.09708827
Monoisotopic Mass:252.09708827
Topological Polar Surface Area:133
Heavy Atom Count:18
Complexity:333
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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