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Bensulfuron-methyl

CAT: 0013-GTR19172398-02Size: 1 ml x 10 mM (in DMSO)Dry Ice: NoHazardous: No
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CAT#:0013-GTR19172398-02Size:1 ml x 10 mM (in DMSO)
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Bensulfuron-methyl (F 5384) is a selective sulfonylurea herbicide used to control broadleaf weeds in rice paddies. It is widely applied in agricultural research and serves as a key tool for studying acetolactate synthase (ALS) inhibition in both plant physiology experiments and environmental fate studies.
CAS Number
83055-99-6
Product Name Alternative
Sulfonylurea, weeds, F 5384, F5384, F-5384, Inhibitor, herbicide, inhibit, DPX 84, DPX84, DPX-84, Bensulfuron methyl, Bensulfuronmethyl, Bensulfuron-methyl, broad-leaf
Purity
98.59% (May vary between batches)
Solubility
DMSO:36.67 mg/mL (89.35 mM)
Smiles
COC (=O) c1ccccc1CS (=O) (=O) NC (=O) Nc1nc (OC) cc (OC) n1
Molecular Formula
C16H18N4O7S
Molecular Weight
410.4
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Bensulfuron-methyl

Bensulfuron-methyl is the methyl ester of bensulfuron. An acetolactate synthase inhibitor, it is used as a herbicide for the control of a variety of both annual and perennial weeds in crops, particularly wheat and rice. It is not licensed for use within the UK. It has a role as an EC 2.2.1.6 (acetolactate synthase) inhibitor, a herbicide and an agrochemical. It is a methyl ester, an aromatic ether, a member of pyrimidines and a N-sulfonylurea. It is functionally related to a bensulfuron.

CAS Number83055-99-6
PubChem CID54960
IUPAC Namemethyl 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoylmethyl]benzoate
Molecular FormulaC16H18N4O7S
Molecular Weight410.4
XLogP1.6
Topological Polar Surface Area154
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count9
Rotatable Bond Count8
Heavy Atom Count28
Formal Charge0
Complexity627
SMILES
COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)CC2=CC=CC=C2C(=O)OC)OC
InChI
InChI=1S/C16H18N4O7S/c1-25-12-8-13(26-2)18-15(17-12)19-16(22)20-28(23,24)9-10-6-4-5-7-11(10)14(21)27-3/h4-8H,9H2,1-3H3,(H2,17,18,19,20,22)
InChIKey
XMQFTWRPUQYINF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Bensulfuron-methyl
CAS: 83055-99-6
CID: 54960
Formula: C16H18N4O7S
MW: 410.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight410.4
XLogP31.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count9
Rotatable Bond Count8
Exact Mass410.08962010
Monoisotopic Mass410.08962010
Topological Polar Surface Area154 Ų
Heavy Atom Count28
Formal Charge0
Complexity627
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

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