imiprothrin - analytical standard

Cat. No.: I292555

GRADE & PURITY Analytical standard

Synonyms

Imiprothrin|72963-72-5|Pralle|DTXSID8034669|(2,5-dioxo-3-prop-2-ynylimidazolidin-1-yl)methyl 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate|L-Prolinamide, 5-oxo-L-prolyl-D-tyrosyl-|Pralle T|Imiprothrin [ISO]|UNII-73OFA861WY|HSDB 7003|NCGC0

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Synonyms

Imiprothrin | 72963-72-5 | Pralle | DTXSID8034669 | (2, 5-dioxo-3-prop-2-ynylimidazolidin-1-yl)methyl 2, 2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate | L-Prolinamide, 5-oxo-L-prolyl-D-tyrosyl- | Pralle T | Imiprothrin [ISO] | UNII-73OFA861WY | HSDB 7003 | NCGC0

Specifications & Purity

analytical standard

Storage

Store at 2-8°C

Shipped In

Wet ice

This product requires cold chain shipping. Ground and other economy services are not available.

Grade

Analytical standard

Names and Identifiers

• Canonical Smiles: CC(=CC1C(C1(C)C)C(=O)OCN2C(=O)CN(C2=O)CC#C)C
• IUPAC Name: (2,5-dioxo-3-prop-2-ynylimidazolidin-1-yl)methyl 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate
• InChIKey: VPRAQYXPZIFIOH-UHFFFAOYSA-N
• INCHI: 1S/C17H22N2O4/c1-6-7-18-9-13(20)19(16(18)22)10-23-15(21)14-12(8-11(2)3)17(14,4)5/h1,8,12,14H,7,9-10H2,2-5H3

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Class Azolidines
      • Subclass Imidazolidines
        • Level5 Imidazolidinones
          • Level6 Imidazolidinediones
            • Level7 Hydantoins

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Azolidines
• Subclass: Imidazolidines
• Intermediate Tree Nodes: Imidazolidinones - Imidazolidinediones
• Direct Parent: Hydantoins
• Alternative Parents: Monocyclic monoterpenoids Alpha amino acids and derivatives N-acyl ureas Cyclopropanecarboxylic acids and derivatives Dicarboximides Carboxylic acid esters Monocarboxylic acids and derivatives Azacyclic compounds Acetylides Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Hydantoin - Alpha-amino acid or derivatives - Monocyclic monoterpenoid - Monoterpenoid - N-acyl urea - Ureide - Cyclopropanecarboxylic acid or derivatives - Dicarboximide - Carboxylic acid ester - Carbonic acid derivative - Urea - Azacycle - Monocarboxylic acid or derivatives - Acetylide - Carboxylic acid derivative - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - Aliphatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as hydantoins. These are heterocyclic compounds containing an imidazolidine substituted by ketone group at positions 2 and 4.
• External Descriptors: cyclopropanes - imidazolidinone

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Chemical and Physical Properties

• Solubility: Insoluble in water, soluble in methanol, acetone, xylene and other organic solvents.
• Molecular Weight: 318.400 g/mol
• XLogP3: 2.100
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 318.158 Da
• Monoisotopic Mass: 318.158 Da
• Topological Polar Surface Area: 66.900 Ų
• Heavy Atom Count: 23
• Formal Charge: 0
• Complexity: 622.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 2
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1