131807-57-3
Product Name:
Famoxadone
Formula:
C22H18N2O4
Synonyms:
3-Anilino-5-methyl-5-(4-phenoxyphenyl)oxazolidine-2,4-dione
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CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Pale cream-colored solid; [HSDB] White powder; [MSDSonline] |
|---|---|
| Color/Form | Pale cream powder |
| Melting Point | 140.3-141.8 °C |
| Solubility | In water, 143 ug/L at pH 2; 191 ug/L at pH 3; 243 ug/L at pH 5; 111 ug/L at pH 7; 38 ug/L at pH 9 |
| Density | 1.31 g/cu cm at 22 °C |
| Vapor Pressure | 4.80X10-9 mm Hg at 20 °C |
| LogP | log Kow = 4.65 at pH 7 |
| Henry's Law Constant | Henry's Law constant = 4.6X10-8 atm-cu m/mol at 20 °C /Estimated/ |
| Stability/Shelf Life | The product is compatible with aluminum or iron metal and stable when exposed to ferric chloride, in the dark. /from table/ |
| pH | pH of 1% aqueous suspension = 6.56 @ 20 °C |
| Dissociation Constants | pKa = 10 /Estimated/ |
| Other Experimental Properties | log Kow = 4.59 at pH 3; 4.80 at pH 5; 5.55 at pH 9 |
| Chemical Classes | Pesticides -> Fungicides |
SAFETY INFORMATION
| Signal word | Danger |
|---|---|
| Pictogram(s) |
 Flame Flammables GHS02  Exclamation Mark Irritant GHS07 |
| GHS Hazard Statements |
H225:Flammable liquids H302:Acute toxicity,oral H312:Acute toxicity,dermal H319:Serious eye damage/eye irritation H332:Acute toxicity,inhalation |
| Precautionary Statement Codes |
P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking. P280:Wear protective gloves/protective clothing/eye protection/face protection. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. |
COMPUTED DESCRIPTORS
| Molecular Weight | 374.4 g/mol |
|---|---|
| XLogP3 | 5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 5 |
| Exact Mass | 374.12665706 g/mol |
| Monoisotopic Mass | 374.12665706 g/mol |
| Topological Polar Surface Area | 67.9 Ų |
| Heavy Atom Count | 28 |
| Formal Charge | 0 |
| Complexity | 563 |
| 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
5-methyl-5-(4-phenoxyphenyl)-3-(phenylamino)-1,3-oxazolidine-2,4-dione is a member of the class of oxazolidinones that is 1,3-oxazolidine-2,4-dione in which the hydrogen attached to the nitrogen is substituted by a phenylamino group and the hydrogens at position 5 are substituted by methyl and 4-phenoxyphenyl groups. It is an aromatic ether, a carbohydrazide and an oxazolidinone.