2-(3,4-dioxonaphthalen-1-yl)acetonitrile

Modify Date: 2025-08-25 11:49:43

2-(3,4-dioxonaphthalen-1-yl)acetonitrile Structure
2-(3,4-dioxonaphthalen-1-yl)acetonitrile structure
Common Name 2-(3,4-dioxonaphthalen-1-yl)acetonitrile
CAS Number 79971-37-2 Molecular Weight 197.18900
Density 1.301g/cm3 Boiling Point 390.8ºC at 760 mmHg
Molecular Formula C12H7NO2 Melting Point N/A
MSDS N/A Flash Point 190.1ºC

 Names

Name 2-(3,4-dioxonaphthalen-1-yl)acetonitrile

 Chemical & Physical Properties

Density 1.301g/cm3
Boiling Point 390.8ºC at 760 mmHg
Molecular Formula C12H7NO2
Molecular Weight 197.18900
Flash Point 190.1ºC
Exact Mass 197.04800
PSA 57.93000
LogP 1.74908
Index of Refraction 1.604
InChIKey SLPMXVHDTVILCZ-UHFFFAOYSA-N
SMILES N#CCC1=CC(=O)C(=O)c2ccccc21

 Synthetic Route

~%

2-(3,4-dioxonaphthalen-1-yl)acetonitrile Structure

2-(3,4-dioxonap...

CAS#:79971-37-2

Literature: Gates; Newhall Journal of the American Chemical Society, 1948 , vol. 70, p. 2261

~%

2-(3,4-dioxonaphthalen-1-yl)acetonitrile Structure

2-(3,4-dioxonap...

CAS#:79971-37-2

Literature: Gates; Newhall Journal of the American Chemical Society, 1948 , vol. 70, p. 2261

~%

2-(3,4-dioxonaphthalen-1-yl)acetonitrile Structure

2-(3,4-dioxonap...

CAS#:79971-37-2

Literature: Gates et al. Journal of the American Chemical Society, 1950 , vol. 72, p. 1141,5803

 Precursor & DownStream

Precursor  2

DownStream  0

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