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Home >> Chemical Listing >> Page 1724 >> (3,4-Dioxo-1,5-Cyclohexadien-1-Yl)Acetonitrile

(3,4-Dioxo-1,5-Cyclohexadien-1-Yl)Acetonitrile
[CAS# 522633-51-8]

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Identification
Name (3,4-Dioxo-1,5-Cyclohexadien-1-Yl)Acetonitrile
Synonyms 2-(3,4-dioxocyclohexa-1,5-dien-1-yl)acetonitrile
Molecular Structure CAS#: 522633-51-8, (3,4-Dioxo-1,5-Cyclohexadien-1-Yl)Acetonitrile
Molecular Formula C8H5NO2
Molecular Weight 147.13
CAS Registry Number 522633-51-8
SMILES O=C1/C=C(\C=C/C1=O)CC#N
InChI 1S/C8H5NO2/c9-4-3-6-1-2-7(10)8(11)5-6/h1-2,5H,3H2
InChIKey VQKUKDLUQNZIBI-UHFFFAOYSA-N
Properties
Density 1.28g/cm3 (Cal.)
Boiling point 322.028°C at 760 mmHg (Cal.)
Flash point 148.558°C (Cal.)
Refractive index 1.545 (Cal.)
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