2-Butyl-5-nitro-1H-isoindole-1,3(2H)-dione

CAS Registry Number®

54395-37-8
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CAS Name

2-Butyl-5-nitro-1H-isoindole-1,3(2H)-dione

Molecular Formula

C12H12N2O4

Molecular Mass

248.23

Cite this Page

2-Butyl-5-nitro-1H-isoindole-1,3(2H)-dione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=54395-37-8 (retrieved 2024-06-20) (CAS RN: 54395-37-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    94-95 °C

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C12H12N2O4/c1-2-3-6-13-11(15)9-5-4-8(14(17)18)7-10(9)12(13)16/h4-5,7H,2-3,6H2,1H3

InChIKey

InChIKey=LSVBBJVITBGNFC-UHFFFAOYSA-N

SMILES

O=C1C=2C(C(=O)N1CCCC)=CC=C(N(=O)=O)C2

Canonical SMILES

O=C1C2=CC=C(C=C2C(=O)N1CCCC)N(=O)=O

Other Names for this Substance

  • 1H-Isoindole-1,3(2H)-dione, 2-butyl-5-nitro-
  • 2-Butyl-5-nitro-1H-isoindole-1,3(2H)-dione
  • N-Butyl-4-nitrophthalimide
  • 4-Nitro-N-butylphthalimide
  • 2-Butyl-5-nitro-isoindole-1,3-dione

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