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13121-70-5

13121-70-5 structural image
Product Name: Cyhexatin
Formula: C18H34OSn
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Technical cyhexatin is a nearly odorless white crystalline powder that has no true melting point but degrades to bis(tricyclohexyl)tin oxide at 121 to 131 °C which decomposes at 228 °C; a melting point of 195-198 °C is also reported. Very insoluble in water (less than 1 mg/L at 25 °C), but wettable by water. Soluble in some organic solvents (acetone 1.3 g/L; xylenes 3.6 g/L; carbon tetrachloride 28 g/L; dichloromethane 34 g/L). Used as an acaricide (an agent to kill plant-feeding mites) in almonds, walnuts, hops and some fruits.
Color/Form White crystalline powder
Odor Nearly odorless
Boiling Point 442 °F at 760 mmHg (Decomposes) (NIOSH, 2023)
Melting Point 383 °F (NIOSH, 2023)
Solubility Insoluble (NIOSH, 2023)
Vapor Pressure 0 mmHg (approx) (NIOSH, 2023)
Stability/Shelf Life STABLE TO 100 °C IN AQUEOUS SUSPENSIONS FROM SLIGHTLY ACID (PH 6) TO ALKALINE; DEGRADED BY U.V. LIGHT.
Decomposition When heated to decomp ... emits acrid smoke and irritating fumes.
Kovats Retention Index 2511.3
Chemical Classes Metals -> Tin Compounds, Organic

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Skull and Crossbones
Acute Toxicity
GHS06

Environment
GHS09
GHS Hazard Statements H301:Acute toxicity,oral
H410:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P273:Avoid release to the environment.
P391:Collect spillage. Hazardous to the aquatic environment

COMPUTED DESCRIPTORS

Molecular Weight 386.2 g/mol
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 3
Exact Mass 387.170993 g/mol
Monoisotopic Mass 387.170993 g/mol
Topological Polar Surface Area 1 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 207
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 2
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Technical cyhexatin is a nearly odorless white crystalline powder that has no true melting point but degrades to bis(tricyclohexyl)tin oxide at 121 to 131 °C which decomposes at 228 °C; a melting point of 195-198 °C is also reported. Very insoluble in water (less than 1 mg/L at 25 °C), but wettable by water. Soluble in some organic solvents (acetone 1.3 g/L; xylenes 3.6 g/L; carbon tetrachloride 28 g/L; dichloromethane 34 g/L). Used as an acaricide (an agent to kill plant-feeding mites) in almonds, walnuts, hops and some fruits.