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5-Formylisophthalonitrile
[CAS# 331714-58-0]

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Identification
Name 5-Formylisophthalonitrile
Molecular Structure CAS#: 331714-58-0, 5-Formylisophthalonitrile
Molecular Formula C9H4N2O
Molecular Weight 156.14
CAS Registry Number 331714-58-0
SMILES N#Cc1cc(cc(C#N)c1)C=O
InChI 1S/C9H4N2O/c10-4-7-1-8(5-11)3-9(2-7)6-12/h1-3,6H
InChIKey TXKYUJKLEQNBAO-UHFFFAOYSA-N
Properties
Density 1.265g/cm3 (Cal.)
Boiling point 214.528°C at 760 mmHg (Cal.)
Flash point 83.544°C (Cal.)
Refractive index 1.576 (Cal.)
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