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Pyrithiobac-sodium

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Name

Pyrithiobac-sodium

EINECS N/A
CAS No. 123343-16-8 Density N/A
PSA 109.67000 LogP 1.66190
Solubility water: 705 g/L (pH7) Melting Point 233-234 °C
Formula C13H11ClN2O38S.Na Boiling Point 546.4 °C at 760 mmHg
Molecular Weight 348.74 Flash Point 284.3 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 123343-16-8 (Pyrithiobac-sodium) Hazard Symbols N/A
Synonyms

Benzoicacid, 2-chloro-6-[(4,6-dimethoxy-2-pyrimidinyl)thio]-, sodium salt (9CI);DPX-PE 350;KIH 2031;Pyrithiobac sodium salt;Staple;Staple 85SP;

 

Pyrithiobac-sodium Chemical Properties

Product Name: Pyrithiobac-sodium (CAS NO.123343-16-8)

Molecular Formula: C13H10ClN2NaO4S
Molecular Weight: 348.74g/mol
Mol File: 123343-16-8.mol
Melting Point: 233-234°C
Boiling point: 546.4 °C at 760 mmHg
Storage Temperature: 0-6°C
Flash Point: 284.3 °C
Water Solubility: 705 g/L (pH7)
Enthalpy of Vaporization: 86.88 kJ/mol
Vapour Pressure: 8.97E-13 mmHg at 25°C
H-Bond Donor: 0
H-Bond Acceptor: 6
Structure Descriptors of Pyrithiobac-sodium (CAS NO.123343-16-8):
  IUPAC Name: sodium 2-chloro-6-(4,6-dimethoxypyrimidin-2-yl)sulfanylbenzoate
  Canonical SMILES: COC1=CC(=NC(=N1)SC2=C(C(=CC=C2)Cl)C(=O)[O-])OC.[Na+]
  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);/q;+1/p-1 
  InChIKey: CNILNQMBAHKMFS-UHFFFAOYSA-M

Pyrithiobac-sodium Specification

 Pyrithiobac-sodium , its CAS NO. is 123343-16-8, the synonyms are Sodium 2-chloro-6-((4,6-dimethoxy-2-pyrimidinyl)thio0benzoate ; Sodium 2-chloro-6-(4,6-dimethoxypyrimidin-2-ylthio)benzoate ; Staple ;  Staple 85SP ; Benzoic acid, 2-chloro-6-((4,6-dimethoxy-2-pyrimidinyl)thio)-, sodiu, salt ; Benzoic acid, 2-chloro-6-((4,6-dimethoxy-2-pyrimidinyl)thio)-, sodium salt .

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