Pyrithiobac sodium

CAS Registry Number®

123343-16-8

CAS Name

Pyrithiobac sodium

Molecular Formula

C13H11ClN2O4S.Na

Cite this Page

Pyrithiobac sodium.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=123343-16-8 (retrieved 2024-11-22) (CAS RN: 123343-16-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    248 °C

Source(s)

  • (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C13H11ClN2O4S.Na/c1-19-9-6-10(20-2)16-13(15-9)21-8-5-3-4-7(14)11(8)12(17)18;/h3-6H,1-2H3,(H,17,18);

InChIKey

InChIKey=UALFPVHPUAEMKU-UHFFFAOYSA-N

SMILES

C(O)(=O)C1=C(SC=2N=C(OC)C=C(OC)N2)C=CC=C1Cl.[Na]

Canonical SMILES

[Na].O=C(O)C=1C(Cl)=CC=CC1SC=2N=C(OC)C=C(N2)OC

Other Names for this Substance

  • Benzoic acid, 2-chloro-6-[(4,6-dimethoxy-2-pyrimidinyl)thio]-, sodium salt (1:1)
  • Benzoic acid, 2-chloro-6-[(4,6-dimethoxy-2-pyrimidinyl)thio]-, sodium salt
  • KIH 2031
  • DPX-PE 350
  • Pyrithiobac sodium salt

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CAS INSIGHTSTM
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