2,4-Dinitrophenyl thiocyanate

CAS Registry Number®

1594-56-5

CAS Name

2,4-Dinitrophenyl thiocyanate

Molecular Formula

C7H3N3O4S

Molecular Mass

225.18

Cite this Page

2,4-Dinitrophenyl thiocyanate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1594-56-5 (retrieved 2024-11-22) (CAS RN: 1594-56-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    138-139 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C7H3N3O4S/c8-4-15-7-2-1-5(9(11)12)3-6(7)10(13)14/h1-3H

InChIKey

InChIKey=XQDQRCRASHAZBA-UHFFFAOYSA-N

SMILES

N(=O)(=O)C1=C(SC#N)C=CC(N(=O)=O)=C1

Canonical SMILES

N#CSC1=CC=C(C=C1N(=O)=O)N(=O)=O

Other Names for this Substance

  • Thiocyanic acid, 2,4-dinitrophenyl ester
  • Benzene, 2,4-dinitro-1-thiocyanato-
  • 2317W
  • 2,4-Dinitrophenyl thiocyanate
  • 2,4-Dinitro-1-thiocyanobenzene

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration