4,4′-Dithiobis[5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-1H-pyrazole-3-carbonitrile]

CAS Registry Number®

130755-46-3
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CAS Name

4,4′-Dithiobis[5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-1H-pyrazole-3-carbonitrile]

Molecular Formula

C22H8Cl4F6N8S2

Molecular Mass

704.28

Cite this Page

4,4′-Dithiobis[5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-1H-pyrazole-3-carbonitrile].   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=130755-46-3 (retrieved 2024-09-07) (CAS RN: 130755-46-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    >300 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C22H8Cl4F6N8S2/c23-9-1-7(21(27,28)29)2-10(24)15(9)39-19(35)17(13(5-33)37-39)41-42-18-14(6-34)38-40(20(18)36)16-11(25)3-8(4-12(16)26)22(30,31)32/h1-4H,35-36H2

InChIKey

InChIKey=KYWRZLCFDFEWBI-UHFFFAOYSA-N

SMILES

NC=1N(N=C(C#N)C1SSC=2C(C#N)=NN(C2N)C3=C(Cl)C=C(C(F)(F)F)C=C3Cl)C4=C(Cl)C=C(C(F)(F)F)C=C4Cl

Canonical SMILES

N#CC1=NN(C(N)=C1SSC=2C(C#N)=NN(C2N)C3=C(Cl)C=C(C=C3Cl)C(F)(F)F)C4=C(Cl)C=C(C=C4Cl)C(F)(F)F

Other Names for this Substance

  • 1H-Pyrazole-3-carbonitrile, 4,4′-dithiobis[5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-
  • 4,4′-Dithiobis[5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-1H-pyrazole-3-carbonitrile]