1001203-03-7

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1001203-03-7 Structure

Identification	Back Directory
[Name] 3-Ethynyl-4-methyl-benzoic acid
[CAS] 1001203-03-7
[Synonyms] Ponatinib Impurity 8 3-Ethynyl-4-methyl-benzoic acid Benzoic acid, 3-ethynyl-4-methyl-
[Molecular Formula] C10H8O2
[MDL Number] MFCD20646092
[MOL File] 1001203-03-7.mol
[Molecular Weight] 160.17

Chemical Properties	Back Directory
[Boiling point ] 323.5±35.0 °C(Predicted)
[density ] 1.19±0.1 g/cm3(Predicted)
[pka] 4.16±0.10(Predicted)
[InChI] InChI=1S/C10H8O2/c1-3-8-6-9(10(11)12)5-4-7(8)2/h1,4-6H,2H3,(H,11,12)
[InChIKey] FXLGXUBFIWFPJA-UHFFFAOYSA-N
[SMILES] C(O)(=O)C1=CC=C(C)C(C#C)=C1

Safety Data	Back Directory
[Symbol(GHS) ] GHS07
[Signal word ] Warning
[Hazard statements ] H302+H312+H332-H315-H319-H335
[Precautionary statements ] P271-P260-P280
[HS Code ] 2916399090

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