2-Nitrobenzeneacetonitrile

CAS Registry Number®

610-66-2
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CAS Name

2-Nitrobenzeneacetonitrile

Molecular Formula

C8H6N2O2

Molecular Mass

162.15

Cite this Page

2-Nitrobenzeneacetonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=610-66-2 (retrieved 2024-04-27) (CAS RN: 610-66-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    178 °C @ Press: 12 Torr
  • Melting Point (2)

    84 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C8H6N2O2/c9-6-5-7-3-1-2-4-8(7)10(11)12/h1-4H,5H2

InChIKey

InChIKey=YPRFCQAWSNWRLM-UHFFFAOYSA-N

SMILES

N(=O)(=O)C1=C(CC#N)C=CC=C1

Canonical SMILES

N#CCC=1C=CC=CC1N(=O)=O

Other Names for this Substance

  • Benzeneacetonitrile, 2-nitro-
  • Acetonitrile, (o-nitrophenyl)-
  • 2-Nitrobenzeneacetonitrile
  • o-Nitrobenzacetonitrile
  • (2-Nitrophenyl)acetonitrile

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