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4-(Phenylmethyl)-5-Sulfanylidene-1,2,4-Triazolidin-3-One
[CAS# 119482-69-8]

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Identification
Name 4-(Phenylmethyl)-5-Sulfanylidene-1,2,4-Triazolidin-3-One
Synonyms 4-(Phenylmethyl)-5-Thioxo-1,2,4-Triazolidin-3-One; 4-(Benzyl)-5-Thioxo-1,2,4-Triazolidin-3-One; T0516-5962
Molecular Structure CAS#: 119482-69-8, 4-(Phenylmethyl)-5-Sulfanylidene-1,2,4-Triazolidin-3-One
Molecular Formula C9H9N3OS
Molecular Weight 207.25
CAS Registry Number 119482-69-8
SMILES C2=C(CN1C(=S)NNC1=O)C=CC=C2
InChI 1S/C9H9N3OS/c13-8-10-11-9(14)12(8)6-7-4-2-1-3-5-7/h1-5H,6H2,(H,10,13)(H,11,14)
InChIKey NVHZYKDMJINPIN-UHFFFAOYSA-N
Properties
Density 1.428g/cm3 (Cal.)
Boiling point 457.8°C at 760 mmHg (Cal.)
Flash point 230.7°C (Cal.)
Market Analysis Reports
List of Reports Available for 4-(Phenylmethyl)-5-Sulfanylidene-1,2,4-Triazolidin-3-One
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