Identification Chemical Properties Safety Data Hazard Information Supplier

253585-83-0

Name 1-[4-(Phenylthio)phenyl]-1,2-octanedione 2-(O-benzoyloxime)
CAS 253585-83-0
Molecular Formula C27H27NO3S
MDL Number MFCD12911795
Molecular Weight 445.57
MOL File 253585-83-0.mol

Chemical Properties

Boiling point  594.7±52.0 °C(Predicted)
density  1.11±0.1 g/cm3(Predicted)
storage temp.  Sealed in dry,2-8°C
InChI InChI=1S/C27H27NO3S/c1-2-3-4-11-16-25(28-31-27(30)22-12-7-5-8-13-22)26(29)21-17-19-24(20-18-21)32-23-14-9-6-10-15-23/h5-10,12-15,17-20H,2-4,11,16H2,1H3
InChIKey LOCXTTRLSIDGPS-UHFFFAOYSA-N
SMILES C(C1=CC=C(SC2=CC=CC=C2)C=C1)(=O)C(=NOC(=O)C1=CC=CC=C1)CCCCCC
EPA Substance Registry System 1,2-Octanedione, 1-[4-(phenylthio)phenyl]-, 2-(O-benzoyloxime) (253585-83-0)

Hazard Information

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