4-propan-2-yl-5-sulfanylidene-1,2,4-triazolidin-3-one
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4-propan-2-yl-5-sulfanylidene-1,2,4-triazolidin-3-one
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CAS No:
53065-47-7
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Formula:
C5H9N3OS
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Chemical Name:
4-propan-2-yl-5-sulfanylidene-1,2,4-triazolidin-3-one
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Synonyms:
4-isopropyl-5-mercapto-4H-1,2,4-triazol-3-ol;
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CAS No:
4-propan-2-yl-5-sulfanylidene-1,2,4-triazolidin-3-one Basic Attributes
159.20900
159.04663309
DTXSID20372478
2933990090
Computed Properties
Molecular Weight:159.21
XLogP3:0.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:159.04663309
Monoisotopic Mass:159.04663309
Topological Polar Surface Area:76.5
Heavy Atom Count:10
Complexity:180
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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