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3-Sulfanylisonicotinamide
[CAS# 118966-06-6]

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Identification
Name 3-Sulfanylisonicotinamide
Synonyms 3-mercaptoisonicotinamide
Molecular Structure CAS#: 118966-06-6, 3-Sulfanylisonicotinamide
Molecular Formula C6H6N2OS
Molecular Weight 154.19
CAS Registry Number 118966-06-6
SMILES c1cncc(c1C(=O)N)S
InChI 1S/C6H6N2OS/c7-6(9)4-1-2-8-3-5(4)10/h1-3,10H,(H2,7,9)
InChIKey CCPQKXMJXCAVKP-UHFFFAOYSA-N
Properties
Density 1.353g/cm3 (Cal.)
Boiling point 343.92°C at 760 mmHg (Cal.)
Flash point 161.797°C (Cal.)
Refractive index 1.648 (Cal.)
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