845885-90-7

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845885-90-7 Structure

Identification	Back Directory
[Name] 4-FLUORO-3-FORMYL-BENZOIC ACID
[CAS] 845885-90-7
[Synonyms] 4-FLUORO-3-FORMYL-BENZOIC ACID Benzoic acid, 4-fluoro-3-formyl- 4-Fluoro-3-formylbenzoic acid 97%
[Molecular Formula] C8H5FO3
[MDL Number] MFCD06411555
[MOL File] 845885-90-7.mol
[Molecular Weight] 168.12

Chemical Properties	Back Directory
[Melting point ] 152 °C
[Boiling point ] 332.3±27.0 °C(Predicted)
[density ] 1.426±0.06 g/cm3(Predicted)
[pka] 3.79±0.10(Predicted)
[InChI] InChI=1S/C8H5FO3/c9-7-2-1-5(8(11)12)3-6(7)4-10/h1-4H,(H,11,12)
[InChIKey] SKPWEADPCJMLID-UHFFFAOYSA-N
[SMILES] C(O)(=O)C1=CC=C(F)C(C=O)=C1

Safety Data	Back Directory
[Symbol(GHS) ] GHS07
[Signal word ] Warning
[Hazard statements ] H315-H319-H335
[Precautionary statements ] P261-P305+P351+P338
[Hazard Codes ] Xn
[Risk Statements ] 22
[HS Code ] 2916399090

Spectrum Detail	Back Directory
[Spectrum Detail] 4-FLUORO-3-FORMYL-BENZOIC ACID(845885-90-7)¹HNMR

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