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89776-74-9

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89776-74-9 Structure

89776-74-9 Structure

Identification	Back Directory
[Name] 5-Isopropylisoxazole-3-carboxylic acid
[CAS] 89776-74-9
[Synonyms] SBB010358 Albb-009770 BAS 03395090 644730_ALDRICH TIMTEC-BB SBB010358 CHEMBRDG-BB 4003153 5-Isopropylisooxaole-3-carboxylic acid 5-ISOPROPYLISOXAZOLE-3-CARBOXYLIC ACID 5-isopropyl-3-isoxazolecarboxylic acid 5-propan-2-yl-3-isoxazolecarboxylic acid 5-Isopropylisoxazole-3-carboxylic acid 97% 3-isoxazolecarboxylic acid, 5-(1-methylethyl)- 3-Isoxazolecarboxylicacid,5-(1-methylethyl)-(9CI) 5-isopropylisoxazole-3-carboxylic acid(SALTDATA: FREE)
[Molecular Formula] C7H9NO3
[MDL Number] MFCD06738923
[MOL File] 89776-74-9.mol
[Molecular Weight] 155.15

Chemical Properties	Back Directory
[Melting point ] 69-73 °C(lit.)
[Boiling point ] 298.2±28.0 °C(Predicted)
[density ] 1.211±0.06 g/cm3(Predicted)
[storage temp. ] 2-8°C
[form ] solid
[pka] 3.43±0.10(Predicted)
[InChI] 1S/C7H9NO3/c1-4(2)6-3-5(7(9)10)8-11-6/h3-4H,1-2H3,(H,9,10)
[InChIKey] AYWGKTMGWXRLRO-UHFFFAOYSA-N
[SMILES] CC(C)c1cc(no1)C(O)=O

Safety Data	Back Directory
[Symbol(GHS) ] GHS07
[Signal word ] Warning
[Hazard statements ] H302-H315-H319-H335
[Precautionary statements ] P261-P305+P351+P338
[Safety Statements ] 22-24/25
[WGK Germany ] 3
[HazardClass ] IRRITANT
[HS Code ] 2934999090
[Storage Class] 11 - Combustible Solids

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