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125401-75-4

125401-75-4 structural image
Product Name: Bispyribac
Formula: C19H18N4O8
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CHEMICAL AND PHYSICAL PROPERTIES

Color/Form White powder
Melting Point 148-150 °C
Solubility Solubility in water at 25 °C: 733 g/L /Bispyribac sodium salt/
Stability/Shelf Life Stable at normal ambient temperatures. /Bispyribac-sodium; Regiment Herbicide/
Other Experimental Properties White odorless powder. MP: 223-224 °C; VP: 5.05X10-6 mPa at 25 °C. log Kow = -1.03 at 23 °C. Henry's Law constant = 3X10-11 Pa-cu m/mol (calc); Density: 1.47. Solubility in distilled water = 68.7 g/L at 20 °C. Solubility in methanol 25 g/L at 20 °C; in ethyl acetate 6.1X10-2, n-hexane 8.34X10-3, acetone 1.4, toluene <1.0X10-6, dichloromethane 1.2 (all in mg/L, 25 °C). pKa = 3.35 at 20 °C. Technical formulation is >93% /Bispyribac sodium/

COMPUTED DESCRIPTORS

Molecular Weight 430.4 g/mol
XLogP3 3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 12
Rotatable Bond Count 9
Exact Mass 430.11246355 g/mol
Monoisotopic Mass 430.11246355 g/mol
Topological Polar Surface Area 144 Ų
Heavy Atom Count 31
Formal Charge 0
Complexity 509
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Bispyribac is a member of the class of benzoic acids that is benzoic acid substituted by (4,6-dimethoxypyrimidin-2-yl)oxy groups at positions 2 and 6. Its sodium salt is used as a broad spectrum post emergent herbicide for the control of grasses, sedges and broadleaf weeds in rice crops. It has a role as a herbicide. It is an aromatic ether, a member of pyrimidines, a member of benzoic acids and a monocarboxylic acid. It is a conjugate acid of a bispyribac(1-).