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2,3,5,6-Tetrachloro-4-Mercapto-Benzonitrile
[CAS# 20925-31-9]

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Identification
Name 2,3,5,6-Tetrachloro-4-Mercapto-Benzonitrile
Synonyms 1,2,4,5-Tetrafluoro-3-Isothiocyanato-Benzene; 2,3,5,6-Tetrafluorophenyl Isothiocyanate; Zinc04290067
Molecular Structure CAS#: 20925-31-9, 2,3,5,6-Tetrachloro-4-Mercapto-Benzonitrile
Molecular Formula C7HF4NS
Molecular Weight 207.15
CAS Registry Number 20925-31-9
SMILES S=C=NC1=C(C(=CC(=C1F)F)F)F
InChI 1S/C7HF4NS/c8-3-1-4(9)6(11)7(5(3)10)12-2-13/h1H
InChIKey QUNNLKBODYSOQL-UHFFFAOYSA-N
Properties
Density 1.5 (Expl.)
1.5±0.1g/cm3 (Cal.)
Boiling point 228.1±40.0°C at 760 mmHg (Cal.)
98°C (Expl.)
Flash point 91.8±27.3°C (Cal.)
Refractive index 1.558 (Expl.)
Safety Data
Safety Code S26;S36/37/39;S45  Details
Risk Code R20/21/22;R34  Details
Hazard Symbol symbol  symbol  X;C  Details
Transport Information UN2922
Safety Description HARMFUL / IRRITANT
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