4-pentyl-5-sulfanylidene-1,2,4-triazolidin-3-one
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4-pentyl-5-sulfanylidene-1,2,4-triazolidin-3-one
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CAS No:
117987-05-0
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Formula:
C7H13N3OS
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Chemical Name:
4-pentyl-5-sulfanylidene-1,2,4-triazolidin-3-one
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Synonyms:
4-pentyl-5-sulfanyl-1,2,4-triazol-3-ol; 4-Pentyl-5-Thioxo-1,2,4-Triazolidin-3-One; 1,2,4-Triazolidin-3-one,4-pentyl-5-thioxo;
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CAS No:
4-pentyl-5-sulfanylidene-1,2,4-triazolidin-3-one Basic Attributes
187.26300
187.07793322
DTXSID30372505
2933990090
Characteristics
89.74000
1.46260
1.24 g/cm3
146-149ºC
370.3ºC at 760 mmHg
177.8ºC
1.59
5.24E-06mmHg at 25°C
Computed Properties
Molecular Weight:187.27
XLogP3:1.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:187.07793322
Monoisotopic Mass:187.07793322
Topological Polar Surface Area:76.5
Heavy Atom Count:12
Complexity:195
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 4-pentyl-5-sulfanylidene-1,2,4-triazolidin-3-one
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