1,2,4-Trichloro-5-isothiocyanatobenzene

CAS Registry Number®

23165-46-0
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CAS Name

1,2,4-Trichloro-5-isothiocyanatobenzene

Molecular Formula

C7H2Cl3NS

Molecular Mass

238.52

Cite this Page

1,2,4-Trichloro-5-isothiocyanatobenzene.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=23165-46-0 (retrieved 2024-04-29) (CAS RN: 23165-46-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    280 °C

  • Melting Point (2)

    47-49 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C7H2Cl3NS/c8-4-1-6(10)7(11-3-12)2-5(4)9/h1-2H

InChIKey

InChIKey=PJLRSYLEFZNICX-UHFFFAOYSA-N

SMILES

N(=C=S)C1=C(Cl)C=C(Cl)C(Cl)=C1

Canonical SMILES

S=C=NC1=CC(Cl)=C(Cl)C=C1Cl

Other Names for this Substance

  • Benzene, 1,2,4-trichloro-5-isothiocyanato-
  • Isothiocyanic acid, 2,4,5-trichlorophenyl ester
  • 1,2,4-Trichloro-5-isothiocyanatobenzene
  • 2,4,5-Trichlorophenyl isothiocyanate

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