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81335-37-7

81335-37-7 structural image
Product Name: Imazaquin acid
Formula: C17H17N3O3
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Colorless or tan solid; Technical product: Odorless white solid; [HSDB] Yellowish grey solid; [EFSA]
Color/Form Colorless solid
Odor Slightly pungent
Melting Point 219-222 °C (decomposition)
Solubility Sol in water /Imazaquin ammonium salt/
Vapor Pressure <0.013 mPa @ 60 °C
Stability/Shelf Life Stable in aqueous solutions for at least 1 mo, when stored in the dark. Rapidly degraded on exposure to UV light.
Other Experimental Properties Odorless white solid /Technical imazaquin/
Chemical Classes Pesticides -> Herbicides, Imidazolinone

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H312:Acute toxicity,dermal
Precautionary Statement Codes P280:Wear protective gloves/protective clothing/eye protection/face protection.

COMPUTED DESCRIPTORS

Molecular Weight 311.33 g/mol
XLogP3 2.5
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 3
Exact Mass 311.12699141 g/mol
Monoisotopic Mass 311.12699141 g/mol
Topological Polar Surface Area 91.6 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 545
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

2-[4-methyl-5-oxo-4-(propan-2-yl)-4,5-dihydro-1H-imidazol-2-yl]quinoline-3-carboxylic acid is a quinolinemonocarboxylic acid that is quinoline-3-carboxylic acid which is substituted by a 4-methyl-5-oxo-4-(propan-2-yl)-4,5-dihydro-1H-imidazol-2-yl group at position 2. It is a quinolinemonocarboxylic acid, an imidazolone and a monocarboxylic acid.