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Home >> Chemical Listing >> Page 1067 >> 6-(Phenylsulfanyl)Nicotinonitrile

6-(Phenylsulfanyl)Nicotinonitrile
[CAS# 259683-21-1]

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Identification
Name 6-(Phenylsulfanyl)Nicotinonitrile
Synonyms 2-(Phenylthio)pyridine-5-carbonitrile; MFCD00832837
Molecular Structure CAS#: 259683-21-1, 6-(Phenylsulfanyl)Nicotinonitrile
Molecular Formula C12H8N2S
Molecular Weight 212.27
CAS Registry Number 259683-21-1
SMILES N#Cc2cnc(Sc1ccccc1)cc2
InChI 1S/C12H8N2S/c13-8-10-6-7-12(14-9-10)15-11-4-2-1-3-5-11/h1-7,9H
InChIKey JSDVHTWWMQBBRE-UHFFFAOYSA-N
Properties
Density 1.269g/cm3 (Cal.)
Melting point 96-98°C (Expl.)
Boiling point 400.472°C at 760 mmHg (Cal.)
Flash point 195.999°C (Cal.)
Refractive index 1.661 (Cal.)
Safety Data
Safety Description Irritant
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