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23012-17-1

23012-17-1 Structure

23012-17-1 Structure
IdentificationBack Directory
[Name]

2-METHYLISOXAZOLE-4-CARBOXYLIC ACID
[CAS]

23012-17-1
[Synonyms]

4-Carboxy-2-methyl-1,3-oxazole
2-METHYLISOXAZOLE-4-CARBOXYLIC ACID
4-Oxazolecarboxylic acid, 2-methyl-
2-Methyloxazole-4-carboxylic acid 97%
[Molecular Formula]

C5H5NO3
[MDL Number]

MFCD08689557
[MOL File]

23012-17-1.mol
[Molecular Weight]

127.1
Chemical PropertiesBack Directory
[Melting point ]

182-187°C
[Boiling point ]

269.9±13.0 °C(Predicted)
[density ]

1.348±0.06 g/cm3(Predicted)
[storage temp. ]

2-8°C
[form ]

solid
[pka]

3.46±0.10(Predicted)
[color ]

Off white
[InChI]

InChI=1S/C5H5NO3/c1-3-6-4(2-9-3)5(7)8/h2H,1H3,(H,7,8)
[InChIKey]

IARMCEYEYXXEOS-UHFFFAOYSA-N
[SMILES]

O1C=C(C(O)=O)N=C1C
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H412
[Precautionary statements ]

P273-P501
[WGK Germany ]

1
[HS Code ]

2934999090
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Aquatic Chronic 3
Hazard InformationBack Directory
[Uses]

Reactant for:
  • Solid-phase preparation of (heteroaryl)carbonyl-substituted dipeptides as human protease activated receptor 2 affectors
  • Pd-catalyzed decarboxylative C-H cross-coupling
  • Stereoselective preparation of 3-amino-N-(phenylsulfonyl)alanines as inhibitors of ανβ3 integrin
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