7-Nitro-1H-indol-3-yl thiocyanate

CAS Registry Number®

885266-79-5
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CAS Name

7-Nitro-1H-indol-3-yl thiocyanate

Molecular Formula

C9H5N3O2S

Molecular Mass

219.22

Cite this Page

7-Nitro-1H-indol-3-yl thiocyanate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=885266-79-5 (retrieved 2024-08-31) (CAS RN: 885266-79-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    141-143 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H5N3O2S/c10-5-15-8-4-11-9-6(8)2-1-3-7(9)12(13)14/h1-4,11H

InChIKey

InChIKey=IHGLKSNUTFHIAG-UHFFFAOYSA-N

SMILES

S(C#N)C=1C=2C(=C(N(=O)=O)C=CC2)NC1

Canonical SMILES

N#CSC1=CNC2=C1C=CC=C2N(=O)=O

Other Names for this Substance

  • Thiocyanic acid, 7-nitro-1H-indol-3-yl ester
  • 7-Nitro-1H-indol-3-yl thiocyanate
  • [(7-Nitro-1H-indol-3-yl)sulfanyl]formonitrile