51839-16-8

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51839-16-8 Structure

Identification	Back Directory
[Name] 5-iodoisophthalic acid
[CAS] 51839-16-8
[Synonyms] Einecs 257-466-5 5-iodoisophthalic acid 5-Iodo-1,3-benzenedicarboxylic acid 5-iodobenzene-1,3-dicarboxylic acid 1,3-Benzenedicarboxylic acid, 5-iodo-
[EINECS(EC#)] 257-466-5
[Molecular Formula] C8H5IO4
[MDL Number] MFCD12913553
[MOL File] 51839-16-8.mol
[Molecular Weight] 292.03

Chemical Properties	Back Directory
[Boiling point ] 481.0±40.0 °C(Predicted)
[density ] 2.138±0.06 g/cm3(Predicted)
[storage temp. ] 2-8°C, protect from light
[pka] 3.18±0.10(Predicted)
[Appearance] White to light yellow Solid
[InChI] InChI=1S/C8H5IO4/c9-6-2-4(7(10)11)1-5(3-6)8(12)13/h1-3H,(H,10,11)(H,12,13)
[InChIKey] QMDFYAWUWIIQFM-UHFFFAOYSA-N
[SMILES] C1(C(O)=O)=CC(I)=CC(C(O)=O)=C1
[EPA Substance Registry System] 5-Iodoisophthalic acid (51839-16-8)

Safety Data	Back Directory
[Symbol(GHS) ] GHS07
[Signal word ] Warning
[Hazard statements ] H302-H315-H319-H335
[Precautionary statements ] P261-P280-P301+P312-P302+P352-P305+P351+P338
[TSCA ] TSCA listed

Spectrum Detail	Back Directory
[Spectrum Detail] 5-iodoisophthalic acid(51839-16-8)¹HNMR

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