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120738-89-8

120738-89-8 structural image
Product Name: Nitenpyram
Formula: C11H15ClN4O2
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CHEMICAL AND PHYSICAL PROPERTIES

Color/Form Pale yellow crystals
Melting Point 82 °C
Flash Point >70.00 °C (>158.00 def F)
Solubility In water, >570 g/L at 20 °C
Density 1.40 at 26 °C
Vapor Pressure 1.1X10-6 mPa at 20 °C (8.2X10-12 mm Hg)
LogP log Kow = -0.66
Stability/Shelf Life Stable under recommended storage conditions.
Dissociation Constants pKa1 = 3.1; pKa2 = 11.5
Collision Cross Section 160.32 Ų [M+H]+ [CCS Type: TW]

COMPUTED DESCRIPTORS

Molecular Weight 270.71 g/mol
XLogP3 2.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 5
Exact Mass 270.0883534 g/mol
Monoisotopic Mass 270.0883534 g/mol
Topological Polar Surface Area 74 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 306
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Nitenpyram is a C-nitro compound consisting of 2-nitroethene-1,1-diamine where one of the nitrogens bears ethyl and (6-chloro-3-pyridinyl)methyl while the other nitrogen carries a methyl group. It has a role as a neonicotinoid insectide. It is a C-nitro compound and a monochloropyridine. It is functionally related to a 2-chloropyridine.