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Home >> Chemical Listing >> Page 356 >> 6-Isothiocyanato-1,3-Benzothiazole-2(3H)-Thione

6-Isothiocyanato-1,3-Benzothiazole-2(3H)-Thione
[CAS# 132474-66-9]

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Identification
Name 6-Isothiocyanato-1,3-Benzothiazole-2(3H)-Thione
Synonyms 6-isothiocyanatobenzo[d]thiazole-2(3H)-thione
Molecular Structure CAS#: 132474-66-9, 6-Isothiocyanato-1,3-Benzothiazole-2(3H)-Thione
Molecular Formula C8H4N2S3
Molecular Weight 224.33
CAS Registry Number 132474-66-9
SMILES S=C=N\c1ccc2nc(S)sc2c1
InChI 1S/C8H4N2S3/c11-4-9-5-1-2-6-7(3-5)13-8(12)10-6/h1-3H,(H,10,12)
InChIKey IFTGMMRQRKMRGY-UHFFFAOYSA-N
Properties
Density 1.541g/cm3 (Cal.)
Boiling point 396.202°C at 760 mmHg (Cal.)
Flash point 193.416°C (Cal.)
Refractive index 1.811 (Cal.)
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