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Home > Encyclopedia > 4-propan-2-yl-5-sulfanylidene-1,2,4-triazolidin-3-one

4-propan-2-yl-5-sulfanylidene-1,2,4-triazolidin-3-one

4-propan-2-yl-5-sulfanylidene-1,2,4-triazolidin-3-one structure

4-propan-2-yl-5-sulfanylidene-1,2,4-triazolidin-3-one 

structure
  • CAS No:

    53065-47-7

  • Formula:

    C5H9N3OS

  • Chemical Name:

    4-propan-2-yl-5-sulfanylidene-1,2,4-triazolidin-3-one

  • Synonyms:

    4-isopropyl-5-mercapto-4H-1,2,4-triazol-3-ol;

4-propan-2-yl-5-sulfanylidene-1,2,4-triazolidin-3-one Basic Attributes

159.20900

159.04663309

DTXSID20372478

2933990090

Characteristics

89.74000

0.85330

1.34g/cm3

167ºC

347.7ºC at 760mmHg

164.1ºC

1.621

11.1 [ug/mL]

Safety Information

R36/37/38

S26-S37/39

Xi

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

Guide of 4-propan-2-yl-5-sulfanylidene-1,2,4-triazolidin-3-one

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