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89766-91-6

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89766-91-6 Structure

89766-91-6 Structure
IdentificationMore
[Name]

1-Carboxy-1-methylethoxyammonium chloride
[CAS]

89766-91-6
[Synonyms]

2-AMINOOXY-2-METHYLPROPANOIC ACID HYDROCHLORIDE
2-AMINOOXY-2-METHYL-PROPIONIC ACID, HYDROCHLORIDE
2-AMINOXY-2-METHYLPROPIONIC ACID HYDROCHLORIDE
AOIBA
AOIBA:2-AMINOOXY-2-METHYLPROPANOIC ACID HYDROCHLORIDE
1-CARBOXYL-1-METHYLETHOXYAMMONIUM CHLORIDE
1-Carboxy-1-methylethoxyammonium chloride
2-(AMINOOXY)-2-METHYL-,HYDROCHLORIDE
[EINECS(EC#)]

289-523-5
[Molecular Formula]

C4H10ClNO3
[MDL Number]

MFCD08063911
[Molecular Weight]

155.58
[MOL File]

89766-91-6.mol
Chemical PropertiesBack Directory
[Melting point ]

164-166 °C(Solv: ethanol (64-17-5); ethyl ether (60-29-7))
[storage temp. ]

Inert atmosphere,Room Temperature
[solubility ]

Methanol (Slightly), Water (Slightly)
[form ]

Solid
[color ]

Off-White
[InChI]

InChI=1S/C4H9NO3.ClH/c1-4(2,8-5)3(6)7;/h5H2,1-2H3,(H,6,7);1H
[InChIKey]

ZJPZGAAOCIFBDI-UHFFFAOYSA-N
[SMILES]

C(C)(C)(ON)C(O)=O.Cl
[CAS DataBase Reference]

89766-91-6(CAS DataBase Reference)
Safety DataBack Directory
[Symbol(GHS) ]

Flame (GHS02)
GHS02
[Signal word ]

Danger
[Hazard statements ]

H242
[Precautionary statements ]

P210-P234-P235-P240-P370+P378-P403
[WGK Germany ]

WGK 3
[REACH Registrations]

Active
[Storage Class]

5.2 - Organic peroxides and self-reacting hazardous materials
[Hazard Classifications]

Self-react. C
Hazard InformationBack Directory
[Uses]

The Zhu-Yu Auxiliary was reported by Jin-Quan Yu′s lab to be an effective auxiliary for the Pd(II)-catalyzed ?-C(sp3)-H(hetero)arylation of ketones.
[Uses]

1-Carboxy-1-methylethoxyammonium Hydrochloride is used as a reactant in the synthesis of carbon-11 labeled celecoxib derivatives as new candidate PET radioligands for imaging of inflammation.
[reaction suitability]

reaction type: C-C Bond Formation
reagent type: catalyst
reagent type: ligand
reaction type: C-H Activation
Spectrum DetailBack Directory
[Spectrum Detail]

1-Carboxy-1-methylethoxyammonium chloride(89766-91-6)1HNMR
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