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4726-14-1

4726-14-1 structural image
Product Name: NITRALIN
Formula: C13H19N3O6S
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Nitralin is a light yellow to orange solid with a mild odor. Sinks in water. (USCG, 1999)
Color/Form GOLDEN-ORANGE CRYSTALLINE SOLID
Odor MILD CHEMICAL ODOR
Boiling Point greater than 437 °F at 760 mmHg (decomposes) (USCG, 1999)
Melting Point 304 °F (USCG, 1999)
Solubility SOLUBILITY @ 22 °C: 0.6 MG/L IN WATER; 360 G/L IN ACETONE; 330 G/L IN DIMETHYLSULFOXIDE; POORLY SOL IN COMMON HYDROCARBON AND AROMATIC SOLVENTS AND IN COMMON ALCOHOLS
Density greater than 1 at 68 °F (est) (USCG, 1999)
Vapor Pressure 0.00000001 [mmHg]
Stability/Shelf Life INSTABLE TO LIGHT
Autoignition Temperature 435 °F (USCG, 1999)
Corrosivity Noncorrosive
Kovats Retention Index 2447 2411.8 2423.2 2407.4
Chemical Classes Pesticides -> Herbicides, Nitroaromatic

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Environment
GHS09
GHS Hazard Statements H410:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P273:Avoid release to the environment.
P391:Collect spillage. Hazardous to the aquatic environment
P501:Dispose of contents/container to..…

COMPUTED DESCRIPTORS

Molecular Weight 345.37 g/mol
XLogP3 3.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 6
Exact Mass 345.09945651 g/mol
Monoisotopic Mass 345.09945651 g/mol
Topological Polar Surface Area 137 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 491
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Nitralin is a light yellow to orange solid with a mild odor. Sinks in water. (USCG, 1999)