Acetic acid, [(5-ethyl-1H-1,2,4-triazol-3-yl)thio]-, ethyl ester (9CI)
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Acetic acid, [(5-ethyl-1H-1,2,4-triazol-3-yl)thio]-, ethyl ester (9CI)
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CAS No:
449747-35-7
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Formula:
C8H13N3O2S
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Chemical Name:
Acetic acid, [(5-ethyl-1H-1,2,4-triazol-3-yl)thio]-, ethyl ester (9CI)
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Synonyms:
CBKinase1_001588;CBKinase1_013988;CHEMBL4129183;CTK8I7724;HMS1588H01;ZINC285714;STK927279;AKOS000562268;AKOS002376070;MCULE-2053443991
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CAS No:
Acetic acid, [(5-ethyl-1H-1,2,4-triazol-3-yl)thio]-, ethyl ester (9CI) Basic Attributes
215.27272
215.073
Computed Properties
Molecular Weight:215.28
XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:215.07284784
Monoisotopic Mass:215.07284784
Topological Polar Surface Area:93.2
Heavy Atom Count:14
Complexity:191
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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