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Bispyribac

CAT: 0931-T205868-04Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T205868-04Size:25 mg
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CAS Number
125401-75-4
Target
Others
Related Pathways
Others
Purity
0.987
Bioactivity
Bispyribac is a systemic herbicide targeting Hydrilla that removes weeds by inhibiting ALS (acetolactate synthase) and blocking branched-chain amino acid synthesis, while altering soil microbial populations, enzyme activity, and functional microbial diversity in rice soils.
Smiles
O=C(O)C=1C(OC=2N=C(OC)C=C(N2)OC)=CC=CC1OC=3N=C(OC)C=C(N3)OC
Molecular Formula
C19H18N4O8
Molecular Weight
430.37
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Bispyribac

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 a member of benzoic acids, a monocarboxylic acid, an aromatic ether and a member of pyrimidines. It is a conjugate acid of a bispyribac(1-).

CAS Number125401-75-4
PubChem CID443031
IUPAC Name2,6-bis[(4,6-dimethoxypyrimidin-2-yl)oxy]benzoic acid
Molecular FormulaC19H18N4O8
Molecular Weight430.4
XLogP3
Topological Polar Surface Area144
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count12
Rotatable Bond Count9
Heavy Atom Count31
Formal Charge0
Complexity509
SMILES
COC1=CC(=NC(=N1)OC2=C(C(=CC=C2)OC3=NC(=CC(=N3)OC)OC)C(=O)O)OC
InChI
InChI=1S/C19H18N4O8/c1-26-12-8-13(27-2)21-18(20-12)30-10-6-5-7-11(16(10)17(24)25)31-19-22-14(28-3)9-15(23-19)29-4/h5-9H,1-4H3,(H,24,25)
InChIKey
RYVIXQCRCQLFCM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Bispyribac
CAS: 125401-75-4
CID: 443031
Formula: C19H18N4O8
MW: 430.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight430.4
XLogP33
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count12
Rotatable Bond Count9
Exact Mass430.11246355
Monoisotopic Mass430.11246355
Topological Polar Surface Area144 Ų
Heavy Atom Count31
Formal Charge0
Complexity509
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes