1,3,5-Tris(1,1-dimethylethyl)-2-nitrobenzene

CAS Registry Number®

4074-25-3
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CAS Name

1,3,5-Tris(1,1-dimethylethyl)-2-nitrobenzene

Molecular Formula

C18H29NO2

Molecular Mass

291.43

Cite this Page

1,3,5-Tris(1,1-dimethylethyl)-2-nitrobenzene.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=4074-25-3 (retrieved 2024-04-25) (CAS RN: 4074-25-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    204-205 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C18H29NO2/c1-16(2,3)12-10-13(17(4,5)6)15(19(20)21)14(11-12)18(7,8)9/h10-11H,1-9H3

InChIKey

InChIKey=IMDZOFHRUMJNQR-UHFFFAOYSA-N

SMILES

N(=O)(=O)C1=C(C(C)(C)C)C=C(C(C)(C)C)C=C1C(C)(C)C

Canonical SMILES

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

Other Names for this Substance

  • Benzene, 1,3,5-tris(1,1-dimethylethyl)-2-nitro-
  • Benzene, 1,3,5-tri-tert-butyl-2-nitro-
  • 1,3,5-Tris(1,1-dimethylethyl)-2-nitrobenzene
  • 1,3,5-Tri-tert-butyl-2-nitrobenzene
  • 2,4,6-Tri-tert-butyl-1-nitrobenzene

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