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5-Isocyanatoisoquinoline
[CAS# 581812-66-0]

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Identification
Name 5-Isocyanatoisoquinoline
Synonyms 5-isocyanatoisoquinoline
Molecular Structure CAS#: 581812-66-0, 5-Isocyanatoisoquinoline
Molecular Formula C10H6N2O
Molecular Weight 170.17
CAS Registry Number 581812-66-0
SMILES O=C=N/c1cccc2c1ccnc2
InChI 1S/C10H6N2O/c13-7-12-10-3-1-2-8-6-11-5-4-9(8)10/h1-6H
InChIKey JTBAQPOKEMZAEQ-UHFFFAOYSA-N
Properties
Density 1.188g/cm3 (Cal.)
Boiling point 297.242°C at 760 mmHg (Cal.)
Flash point 133.567°C (Cal.)
Refractive index 1.623 (Cal.)
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