Products for Research Use Only

Mesosulfuron-methyl

CAT: 0013-GTR19216708-02Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19216708-02Size:500 mg
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Description
Mesosulfuron-methyl is a systemic herbicide. It is used for post-emergence control of grasses and other weeds in cereals.
CAS Number
208465-21-8
Product Name Alternative
Mesosulfuronmethyl Mesosulfuron methyl | Mesomaxx
Purity
>98% (HPLC)
Smiles
COC (=O) c1ccc (CNS (C) (=O) =O) cc1S (=O) (=O) NC (=O) Nc1nc (OC) cc (OC) n1
Molecular Formula
C17H21N5O9S2
Molecular Weight
503.5
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

Mesosulfuron-methyl

Mesosulfuron-methyl is under investigation in clinical trial NCT01118117 (A Multi-center Clinical Trial of the Misago™ Self-Expanding Stent System for Superficial Femoral Artery).

CAS Number208465-21-8
PubChem CID11409499
IUPAC Namemethyl 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-4-(methanesulfonamidomethyl)benzoate
Molecular FormulaC17H21N5O9S2
Molecular Weight503.5
XLogP0.6
Topological Polar Surface Area209
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count12
Rotatable Bond Count10
Heavy Atom Count33
Formal Charge0
Complexity876
SMILES
COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=C(C=CC(=C2)CNS(=O)(=O)C)C(=O)OC)OC
InChI
InChI=1S/C17H21N5O9S2/c1-29-13-8-14(30-2)20-16(19-13)21-17(24)22-33(27,28)12-7-10(9-18-32(4,25)26)5-6-11(12)15(23)31-3/h5-8,18H,9H2,1-4H3,(H2,19,20,21,22,24)
InChIKey
NIFKBBMCXCMCAO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Mesosulfuron-methyl
CAS: 208465-21-8
CID: 11409499
Formula: C17H21N5O9S2
MW: 503.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight503.5
XLogP30.6
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count12
Rotatable Bond Count10
Exact Mass503.07806961
Monoisotopic Mass503.07806961
Topological Polar Surface Area209 Ų
Heavy Atom Count33
Formal Charge0
Complexity876
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