42287-87-6

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42287-87-6 Structure

Identification	Back Directory
[Name] 3-(3,5-DIMETHYLPHENYL)PROPANOIC ACID
[CAS] 42287-87-6
[Synonyms] 3,5-Dimethylbenzenepropanoic acid Benzenepropanoic acid, 3,5-dimethyl- 3-(3,5-DIMETHYLPHENYL)PROPANOIC ACID 3-(3,5-Dimethyl-phenyl)-propionic acid 3-(3,5-dimethylphenyl)propanoic acid(SALTDATA: FREE)
[Molecular Formula] C11H14O2
[MDL Number] MFCD09055207
[MOL File] 42287-87-6.mol
[Molecular Weight] 178.23

Chemical Properties	Back Directory
[Melting point ] 45-46.5 °C
[Boiling point ] 168-178 °C(Press: 13 Torr)
[density ] 1.074±0.06 g/cm3(Predicted)
[storage temp. ] Inert atmosphere,Room Temperature
[form ] solid
[pka] 4.71±0.10(Predicted)
[InChI] 1S/C11H14O2/c1-8-5-9(2)7-10(6-8)3-4-11(12)13/h5-7H,3-4H2,1-2H3,(H,12,13)
[InChIKey] CCPNDKXTGJGIIV-UHFFFAOYSA-N
[SMILES] O=C(O)CCC1=CC(C)=CC(C)=C1

Safety Data	Back Directory
[Symbol(GHS) ] GHS07
[Signal word ] Warning
[Hazard statements ] H315-H319
[Precautionary statements ] P305+P351+P338
[WGK Germany ] WGK 3
[Storage Class] 11 - Combustible Solids
[Hazard Classifications] Eye Irrit. 2 Skin Irrit. 2

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