3-[1-(4-Bromophenyl)-2-nitroethyl]-1H-indole

CAS Registry Number®

731826-97-4
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CAS Name

3-[1-(4-Bromophenyl)-2-nitroethyl]-1H-indole

Molecular Formula

C16H13BrN2O2

Molecular Mass

345.19

Cite this Page

3-[1-(4-Bromophenyl)-2-nitroethyl]-1H-indole.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=731826-97-4 (retrieved 2024-08-18) (CAS RN: 731826-97-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    121-122 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C16H13BrN2O2/c17-12-7-5-11(6-8-12)15(10-19(20)21)14-9-18-16-4-2-1-3-13(14)16/h1-9,15,18H,10H2

InChIKey

InChIKey=WBEZFUUESLEDAL-UHFFFAOYSA-N

SMILES

C(CN(=O)=O)(C=1C=2C(NC1)=CC=CC2)C3=CC=C(Br)C=C3

Canonical SMILES

O=N(=O)CC(C1=CC=C(Br)C=C1)C2=CNC=3C=CC=CC32

Other Names for this Substance

  • 1H-Indole, 3-[1-(4-bromophenyl)-2-nitroethyl]-
  • 3-[1-(4-Bromophenyl)-2-nitroethyl]-1H-indole