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ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(thiocyanatomethyl)triazole-4-carboxylate

ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(thiocyanatomethyl)triazole-4-carboxylate structure

CAS No:
312267-28-0
Formula:
C9H9N7O3S
Chemical Name:
ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(thiocyanatomethyl)triazole-4-carboxylate
Synonyms:
ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(thiocyanatomethyl)-1H-1,2,3-triazole-4-carboxylate;312267-28-0;ZINC2025366;MFCD01240833;SBB001999;STK757187;AKOS001685062;MCULE-7726279142;ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(thiocyanatomethyl)triazole-4-carboxylate;ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(cyanosulfanyl)methyl]-1H-1,2,3-triazole-4-carboxylate;AG-205/37106145;1-(4-Amino-furazan-3-yl)-5-thiocyanatomethyl-1H-[1,2,3]triazole-4-carboxylic acid ethyl ester;ethyl 1-(4-amino(1,2,5-oxadiazol-3-yl))-5-(cyanothiomethyl)-1,2,3-triazole-4-c arboxylate

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ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(thiocyanatomethyl)triazole-4-carboxylate Basic Attributes

Molecular Weight：

295.28 g/mol

Exact Mass：

295.04875835 g/mol

Characteristics

PSA：

171 Å²

Computed Properties

Molecular Weight:295.28
XLogP3:0.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:6
Exact Mass:295.04875835
Monoisotopic Mass:295.04875835
Topological Polar Surface Area:171
Heavy Atom Count:20
Complexity:402
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(thiocyanatomethyl)triazole-4-carboxylate

Basic Attributes
Characteristics
Computed Properties
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