6302-55-2

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6302-55-2 Structure

Identification	Back Directory
[Name] 1-(4-Chlorophenyl)1,3-butanedione
[CAS] 6302-55-2
[Synonyms] 4-Chlorobenzoylacetone 1-(4-Chlorophenyl)1,3-butanedione 1-(4-Chlorophenyl)butane-1,3-dione, 4'-Chloro-3-oxobutyrophenone
[Molecular Formula] C10H9ClO2
[MDL Number] MFCD00463137
[MOL File] 6302-55-2.mol
[Molecular Weight] 196.64

Chemical Properties	Back Directory
[Melting point ] 73-74 °C
[Boiling point ] 312.0±17.0 °C(Predicted)
[density ] 1.205±0.06 g/cm3(Predicted)
[storage temp. ] under inert gas (nitrogen or Argon) at 2-8°C
[form ] solid
[pka] 8.41±0.10(Predicted)
[InChI] 1S/C10H9ClO2/c1-7(12)6-10(13)8-2-4-9(11)5-3-8/h2-5H,6H2,1H3
[InChIKey] TVWDRSJRFMTIPQ-UHFFFAOYSA-N
[SMILES] O=C(C(C=C1)=CC=C1Cl)CC(C)=O

Safety Data	Back Directory
[Symbol(GHS) ] GHS07
[Signal word ] Warning
[Hazard statements ] H302
[Precautionary statements ] P264-P270-P301+P312-P330-P501
[WGK Germany ] WGK 3
[HS Code ] 2914790090
[Storage Class] 11 - Combustible Solids
[Hazard Classifications] Acute Tox. 4 Oral

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