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1-Oxo-2(1H)-isoquinolinecarbonitrile
[CAS# 70259-62-0]

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Identification
Name 1-Oxo-2(1H)-isoquinolinecarbonitrile
Synonyms 1-oxoisoquinoline-2(1H)-carbonitrile
Molecular Structure CAS#: 70259-62-0, 1-Oxo-2(1H)-isoquinolinecarbonitrile
Molecular Formula C10H6N2O
Molecular Weight 170.17
CAS Registry Number 70259-62-0
SMILES c1ccc2c(c1)ccn(c2=O)C#N
InChI 1S/C10H6N2O/c11-7-12-6-5-8-3-1-2-4-9(8)10(12)13/h1-6H
InChIKey ODZZBFSRMZTTRM-UHFFFAOYSA-N
Properties
Density 1.335g/cm3 (Cal.)
Boiling point 309.196°C at 760 mmHg (Cal.)
Flash point 140.797°C (Cal.)
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