CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | White powder with sharp odor; [ACGIH] |
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Color/Form | White solid |
Odor | Sharp |
Boiling Point | 167.7 °C (decomp) (99.7% purity) |
Melting Point | 112 °C (99.7% purity) |
Solubility | In water, 809 mg/L at 25 °C |
Vapor Pressure | VP: 1.4X10-6 Pa at 20 °C /1.05X10-8 mm Hg/ |
LogP | log Kow = 0.802 |
Henry's Law Constant | Henry's Law constant = 1.2X10-11 atm-cu m/moleat 25 °C |
Surface Tension | 57.5 mN/m (90% saturated solution, 20 °C, 95.6% purity) |
Chemical Classes | Pesticides -> Other Insecticides |
COMPUTED DESCRIPTORS
Molecular Weight | 277.27 g/mol |
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XLogP3 | 2.2 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 7 |
Rotatable Bond Count | 2 |
Exact Mass | 277.04966761 g/mol |
Monoisotopic Mass | 277.04966761 g/mol |
Topological Polar Surface Area | 74.5 Ų |
Heavy Atom Count | 18 |
Formal Charge | 0 |
Complexity | 459 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 2 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
[methyl(oxido){1-[6-(trifluoromethyl)pyridin-3-yl]ethyl}-lambda(6)-sulfanylidene]cyanamide is a member of the class of pyridines that is 5-ethyl-2-trifluoromethylpyridine in which the ethyl group is substituted at position 1 by an N-cyano-S-methylsulfonimidoyl group. The insecticide sulfoxalor is a mixture of the four possible stereoisomers arising from the two tetrahedral stereocentres. It is a member of pyridines, a sulfoximide, a nitrile and an organofluorine compound.