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Home > Encyclopedia > 2-[5-sulfanylidene-3-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-4-yl]acetic acid

2-[5-sulfanylidene-3-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-4-yl]acetic acid

2-[5-sulfanylidene-3-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-4-yl]acetic acid structure

2-[5-sulfanylidene-3-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-4-yl]acetic acid 

structure
  • CAS No:

    892874-27-0

  • Formula:

    C9H9N3O2S2

  • Chemical Name:

    2-[5-sulfanylidene-3-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-4-yl]acetic acid

  • Synonyms:

    (3-Thiophen-2-ylmethyl-5-thioxo-1,5-dihydro-[1,2,4]triazol-4-yl)-acetic acid;

2-[5-sulfanylidene-3-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-4-yl]acetic acid Basic Attributes

255.31700

255.01361889

DTXSID50589214

Characteristics

131.24000

1.67760

1.61g/cm3

431.8ºC

215ºC

1.769

Computed Properties

Molecular Weight:255.3
XLogP3:0.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:255.01361889
Monoisotopic Mass:255.01361889
Topological Polar Surface Area:125
Heavy Atom Count:16
Complexity:346
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 2-[5-sulfanylidene-3-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-4-yl]acetic acid

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