2,2-Dimethyl-5-(1H-pyrrol-2-ylmethylene)-1,3-dioxane-4,6-dione

CAS Registry Number®

23111-03-7

CAS Name

2,2-Dimethyl-5-(1H-pyrrol-2-ylmethylene)-1,3-dioxane-4,6-dione

Molecular Formula

C11H11NO4

Molecular Mass

221.21

Cite this Page

2,2-Dimethyl-5-(1H-pyrrol-2-ylmethylene)-1,3-dioxane-4,6-dione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=23111-03-7 (retrieved 2024-11-22) (CAS RN: 23111-03-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    181-182 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C11H11NO4/c1-11(2)15-9(13)8(10(14)16-11)6-7-4-3-5-12-7/h3-6,12H,1-2H3

InChIKey

InChIKey=BBNAXFLKFJZVEN-UHFFFAOYSA-N

SMILES

C(=C1C(=O)OC(C)(C)OC1=O)C2=CC=CN2

Canonical SMILES

O=C1OC(OC(=O)C1=CC2=CC=CN2)(C)C

Other Names for this Substance

  • 1,3-Dioxane-4,6-dione, 2,2-dimethyl-5-(1H-pyrrol-2-ylmethylene)-
  • Malonic acid, (pyrrol-2-ylmethylene)-, cyclic isopropylidene ester
  • 2,2-Dimethyl-5-(1H-pyrrol-2-ylmethylene)-1,3-dioxane-4,6-dione
  • NSC 332449
  • 2,2-Dimethyl-5-(1H-pyrrol-2-ylmethylidene)-1,3-dioxane-4,6-dione

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