3335-98-6

Name 1-Phenyloxindole
CAS 3335-98-6
EINECS(EC#) 1312995-182-4
Molecular Formula C14H11NO
MDL Number MFCD00234850
Molecular Weight 209.24
MOL File 3335-98-6.mol
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Chemical Properties

Melting point  123-125
Boiling point  443.6±25.0 °C(Predicted)
density  1.228±0.06 g/cm3(Predicted)
vapor pressure  0.002Pa at 20℃
storage temp.  Sealed in dry,Room Temperature
solubility  Practically insoluble in water
form  powder to crystal
pka -3.41±0.20(Predicted)
color  White to Light yellow
Water Solubility  74.3mg/L at 20℃
InChI InChI=1S/C14H11NO/c16-14-10-11-6-4-5-9-13(11)15(14)12-7-2-1-3-8-12/h1-9H,10H2
InChIKey OWPNVXATCSXTBK-UHFFFAOYSA-N
SMILES N1(C2=CC=CC=C2)C2=C(C=CC=C2)CC1=O
LogP 2.6 at 26℃
CAS DataBase Reference 3335-98-6(CAS DataBase Reference)

Safety Data

Hazard Codes  Xi
Hazard Note  Irritant
REACH Registrations Active
HazardClass  IRRITANT
HS Code  2933790090

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