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6-Isothiocyanatoisoquinoline
[CAS# 566944-19-2]

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Identification
Name 6-Isothiocyanatoisoquinoline
Synonyms 6-isothiocyanatoisoquinoline
Molecular Structure CAS#: 566944-19-2, 6-Isothiocyanatoisoquinoline
Molecular Formula C10H6N2S
Molecular Weight 186.23
CAS Registry Number 566944-19-2
SMILES c1cc2cnccc2cc1N=C=S
InChI 1S/C10H6N2S/c13-7-12-10-2-1-9-6-11-4-3-8(9)5-10/h1-6H
InChIKey IBSWGRUXRKNTCG-UHFFFAOYSA-N
Properties
Density 1.205g/cm3 (Cal.)
Boiling point 369.809°C at 760 mmHg (Cal.)
Flash point 177.455°C (Cal.)
Refractive index 1.658 (Cal.)
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