76344-95-1

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76344-95-1 Structure

Identification	Back Directory
[Name] 5-PHENYL-4-ISOXAZOLECARBOXYLIC ACID
[CAS] 76344-95-1
[Synonyms] 5-PHENYLISOXAZOLE-4-CARBOXYLIC ACID 5-PHENYL-4-ISOXAZOLECARBOXYLIC ACID 4-Isoxazolecarboxylicacid, 5-phenyl- 5-phenyl-1,2-oxazole-4-carboxylic acid 5-phenyl-1,2-oxazol-4-carboxylic? acid 5-Phenylisoxazole-4-carboxylic acid 97% JR-9001, 5-Phenylisoxazole-4-carboxylic acid, 97%
[Molecular Formula] C10H7NO3
[MDL Number] MFCD05865189
[MOL File] 76344-95-1.mol
[Molecular Weight] 189.17

Chemical Properties	Back Directory
[Melting point ] 151-155 °C (lit.)
[Boiling point ] 372.7±22.0 °C(Predicted)
[density ] 1.320±0.06 g/cm3(Predicted)
[form ] solid
[pka] 2.48±0.10(Predicted)
[InChI] 1S/C10H7NO3/c12-10(13)8-6-11-14-9(8)7-4-2-1-3-5-7/h1-6H,(H,12,13)
[InChIKey] VUVDFZMYJYNLCH-UHFFFAOYSA-N
[SMILES] OC(=O)c1cnoc1-c2ccccc2

Safety Data	Back Directory
[Hazard Codes ] Xi
[Risk Statements ] 36/37/38
[Safety Statements ] 26-36
[WGK Germany ] 3
[HazardClass ] IRRITANT
[Storage Class] 11 - Combustible Solids
[Hazard Classifications] Eye Irrit. 2 Skin Irrit. 2 STOT SE 3

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