1-(1,1-Dimethylethyl)-2-nitrobenzene

CAS Registry Number®

1886-57-3
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CAS Name

1-(1,1-Dimethylethyl)-2-nitrobenzene

Molecular Formula

C10H13NO2

Molecular Mass

179.22

Cite this Page

1-(1,1-Dimethylethyl)-2-nitrobenzene.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1886-57-3 (retrieved 2024-05-20) (CAS RN: 1886-57-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    114-115 °C @ Press: 10 Torr

  • Melting Point (2)

    -2.56 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C10H13NO2/c1-10(2,3)8-6-4-5-7-9(8)11(12)13/h4-7H,1-3H3

InChIKey

InChIKey=IWTHGPTVKBEURV-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=N(=O)C=1C=CC=CC1C(C)(C)C

Other Names for this Substance

  • Benzene, 1-(1,1-dimethylethyl)-2-nitro-
  • Benzene, 1-tert-butyl-2-nitro-
  • 1-(1,1-Dimethylethyl)-2-nitrobenzene
  • o-Nitro-tert-butylbenzene
  • o-tert-Butylnitrobenzene

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