Flucarbazone-Sodium
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Basic Info
| Common Name | Flucarbazone-Sodium(F05839) |
| 2D Structure | |
| FRCD ID | F05839 |
| CAS Number | 181274-17-9 |
| PubChem CID | 12056760 |
| Formula | C12H10F3N4NaO6S |
| IUPAC Name | sodium;(3-methoxy-4-methyl-5-oxo-1,2,4-triazole-1-carbonyl)-[2-(trifluoromethoxy)phenyl]sulfonylazanide |
| InChI Key | UOUXAYAIONPXDH-UHFFFAOYSA-M |
| InChI | InChI=1S/C12H11F3N4O6S.Na/c1-18-10(24-2)16-19(11(18)21)9(20)17-26(22,23)8-6-4-3-5-7(8)25-12(13,14)15;/h3-6H,1-2H3,(H,17,20);/q;+1/p-1 |
| Canonical SMILES | CN1C(=NN(C1=O)C(=O)[N-]S(=O)(=O)C2=CC=CC=C2OC(F)(F)F)OC.[Na+] |
| Isomeric SMILES | CN1C(=NN(C1=O)C(=O)[N-]S(=O)(=O)C2=CC=CC=C2OC(F)(F)F)OC.[Na+] |
| Synonyms |
UNII-76VQM4L12C
Flucarbazone-sodium
181274-17-9
BAY-MKH 6562
FLUCARBAZONE-NA
MKH 6562
CHEBI:82010
Flucarbazone-sodium [ISO:BSI]
SJO 0498
76VQM4L12C
|
| Classifies |
Pesticide
|
| Update Date | Nov 13, 2018 17:07 |
Chemical Taxonomy
| Kingdom | Organic compounds |
| Superclass | Benzenoids |
| Class | Benzene and substituted derivatives |
| Subclass | Benzenesulfonamides |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Benzenesulfonamides |
| Alternative Parents |
|
| Molecular Framework | Aromatic heteromonocyclic compounds |
| Substituents | Benzenesulfonamide - Benzenesulfonyl group - Phenoxy compound - Phenol ether - Alkyl aryl ether - Sulfonylurea - Azole - 1,2,4-triazole - Sulfonyl - Organosulfonic acid or derivatives - Heteroaromatic compound - Organic sulfonic acid or derivatives - Triazoline - Trihalomethane - Organoheterocyclic compound - Organic alkali metal salt - Organic metal halide - Azacycle - Ether - Organic nitrogen compound - Organic salt - Organic sodium salt - Hydrocarbon derivative - Halomethane - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic oxide - Organopnictogen compound - Organic oxygen compound - Alkyl halide - Alkyl fluoride - Aromatic heteromonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as benzenesulfonamides. These are organic compounds containing a sulfonamide group that is S-linked to a benzene ring. |
Properties
| Property Name | Property Value |
|---|---|
| Molecular Weight | 418.279 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 11 |
| Rotatable Bond Count | 4 |
| Complexity | 711 |
| Monoisotopic Mass | 418.017 |
| Exact Mass | 418.017 |
| Formal Charge | 0 |
| Heavy Atom Count | 27 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Isotope Atom Count | 0 |
| Covalently-Bonded Unit Count | 2 |
MRLs
| Food | Product Code | Country | MRLs | Application Date | Notes |
|---|---|---|---|---|---|
| Eggs | Canada | 0.01mg/kg | |||
| Liver Of Cattle | Canada | 0.05mg/kg | |||
| Liver Of Goats | Canada | 0.05mg/kg | |||
| Liver Of Hogs | Canada | 0.05mg/kg | |||
| Liver Of Horses | Canada | 0.05mg/kg | |||
| Liver Of Sheep | Canada | 0.05mg/kg | |||
| Meat Byproducts (Except Liver) Of Cattle | Canada | 0.01mg/kg | |||
| Meat Byproducts (Except Liver) Of Goats | Canada | 0.01mg/kg | |||
| Meat Byproducts (Except Liver) Of Hogs | Canada | 0.01mg/kg | |||
| Meat Byproducts (Except Liver) Of Horses | Canada | 0.01mg/kg | |||
| Meat Byproducts (Except Liver) Of Sheep | Canada | 0.01mg/kg | |||
| Meat Byproducts Of Poultry | Canada | 0.01mg/kg | |||
| Meat Of Cattle | Canada | 0.01mg/kg | |||
| Meat Of Goats | Canada | 0.01mg/kg | |||
| Meat Of Hogs | Canada | 0.01mg/kg | |||
| Meat Of Horses | Canada | 0.01mg/kg | |||
| Meat Of Poultry | Canada | 0.01mg/kg | |||
| Meat Of Sheep | Canada | 0.01mg/kg | |||
| Milk | Canada | 0.0025mg/kg | |||
| Wheat | Canada | 0.01mg/kg |