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ChemicalBook--->CAS DataBase List--->288-14-2

288-14-2

288-14-2 Structure

288-14-2 Structure
IdentificationMore
[Name]

Isoxazole
[CAS]

288-14-2
[Synonyms]

ISOXAZOLE
1-Oxa-2-azacyclopentadiene
Isooxazole
ISOXAZOLE 98+%
1,2-Oxazole
[EINECS(EC#)]

206-018-7
[Molecular Formula]

C3H3NO
[MDL Number]

MFCD00003149
[Molecular Weight]

69.06
[MOL File]

288-14-2.mol
Chemical PropertiesBack Directory
[Appearance]

Colorless liquid
[Melting point ]

-67.1°C
[Boiling point ]

93-95 °C(lit.)
[density ]

1.078 g/mL at 25 °C(lit.)
[vapor density ]

2.4 (vs air)
[refractive index ]

n20/D 1.427(lit.)
[Fp ]

48 °F
[storage temp. ]

Store at RT.
[solubility ]

167g/l
[form ]

clear liquid
[pka]

-2.0(at 25℃)
[color ]

Colorless to Light yellow
[BRN ]

103773
[InChIKey]

CTAPFRYPJLPFDF-UHFFFAOYSA-N
[Uses]

Natural insecticide.
[CAS DataBase Reference]

288-14-2(CAS DataBase Reference)
[NIST Chemistry Reference]

Isoxazole(288-14-2)
[EPA Substance Registry System]

288-14-2(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

F,Xi
[Risk Statements ]

R11:Highly Flammable.
[Safety Statements ]

S16:Keep away from sources of ignition-No smoking .
S33:Take precautionary measures against static discharges .
S29:Do not empty into drains .
S7/9:Keep container tightly closed and in a well-ventilated place .
[RIDADR ]

UN 1993 3/PG 2
[WGK Germany ]

3
[F ]

10
[Hazard Note ]

Highly Flammable
[TSCA ]

Yes
[HazardClass ]

3
[PackingGroup ]

II
[HS Code ]

29349990
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Hydroxylamine hydrochloride-->Malonaldehyde bis(diethyl acetal)
[Preparation Products]

2-Amino-5-chlorobenzophenone-->Clomazone-->2-AMINO-5-CHLOROBENZOPHENONE OXIME-->6-CHLORO-2-(CHLOROMETHYL)-3-OXIDO-4-PHENYL-QUINAZOLINE-->Isazophos-->Risperidone-->Zonisamide-->5-Chloro-2-(methylamino)benzophenone-->SULFISOXAZOLE ACETYL (200 MG)-->Oxacillin sodium monohydrate-->cyanoacetaldehyde-->3-Ethoxyacrylonitrile-->3-Aminoisoxazole-->4-(CHLOROMETHYL)ISOXAZOLE
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

Isoxazole(288-14-2).msds
Hazard InformationBack Directory
[Description]

Isoxazole(288-14-2), an important class of heterocycles, is a five membered heterocyclic compound that exhibits various pharmacological actions. It is present in some natural products such as ibotenic acid and is also used as a foundation for several drugs such as the COX-2 inhibitor valdecoxib and anti-inflammatory drugs. Isoxazoles are largely applied in the area of pharmaceuticals and therapeutics, including insecticidal, antibacterial, antibiotic, antitumour, antifungal, antituberculosis, anticancer and ulcerogenic. Besides, it has a great effect on reducing blood glucose, eliminating pain, resisting inflammation, killing harmful bacteria, controlling and reducing the risk of HIV.
[Chemical Properties]

A colorless liquid resembling pyridine. It is soluble in water at room temperature up to six times its volume.
[Definition]

ChEBI: A monocyclic heteroarene with a structure consisting of a 5-membered ring containing three carbon atoms and an oxygen and nitrogen atom adjacent to each other. It is the parent of the class of isoxazoles.
[Preparation]

Isoxazoles can be synthesized by various methods, such as the 1,3-dipolar cycloaddition reaction of nitrile oxides with alkynes, the reaction of hydroxylamine with 1,3-diketones or propiolic acid derivatives, etc.
[General Description]

Isoxazole are described as inhibitors of acetylcholinesterase (AChE). Isoxazole ligands bind to and inhibit the Sxc- antiporter.
[Hazard]

Narcotic and psychomimetic effects.
[References]

https://en.wikipedia.org/wiki/Isoxazole
https://pubchem.ncbi.nlm.nih.gov/compound/9254
Spectrum DetailBack Directory
[Spectrum Detail]

Isoxazole(288-14-2)1HNMR
Isoxazole(288-14-2)13CNMR
Isoxazole(288-14-2)IR1
Isoxazole(288-14-2)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

Isoxazole, 99%(288-14-2)
[Alfa Aesar]

Isoxazole, 99%(288-14-2)
[Sigma Aldrich]

288-14-2(sigmaaldrich)
[TCI AMERICA]

Isoxazole,>95.0%(GC)(288-14-2)
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