5,5-Dimethyl-2-(4-nitrophenyl)-1,3-dioxane

CAS Registry Number®

838-42-6
No image available.

CAS Name

5,5-Dimethyl-2-(4-nitrophenyl)-1,3-dioxane

Molecular Formula

C12H15NO4

Molecular Mass

237.25

Cite this Page

5,5-Dimethyl-2-(4-nitrophenyl)-1,3-dioxane.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=838-42-6 (retrieved 2024-08-22) (CAS RN: 838-42-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    87-88 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H15NO4/c1-12(2)7-16-11(17-8-12)9-3-5-10(6-4-9)13(14)15/h3-6,11H,7-8H2,1-2H3

InChIKey

InChIKey=RZNYEPDJXZTRBD-UHFFFAOYSA-N

SMILES

N(=O)(=O)C1=CC=C(C=C1)C2OCC(C)(C)CO2

Canonical SMILES

O=N(=O)C1=CC=C(C=C1)C2OCC(C)(C)CO2

Other Names for this Substance

  • 1,3-Dioxane, 5,5-dimethyl-2-(4-nitrophenyl)-
  • m-Dioxane, 5,5-dimethyl-2-(p-nitrophenyl)-
  • 5,5-Dimethyl-2-(4-nitrophenyl)-1,3-dioxane

Deleted or Replaced CAS Registry Numbers

1448899-47-5