495-84-1

Name 2-ISOPROPYLTHIOXANTHONE
CAS 495-84-1
Molecular Formula C16H14OS
MDL Number MFCD00055658
Molecular Weight 254.35
MOL File 495-84-1.mol
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Chemical Properties

Melting point  232-233° (also given as 251°)
storage temp.  -196°C
solubility  DMF: 10 mg/ml,DMF:PBS (pH 7.2) (1:3): 0.23 mg/ml,DMSO: 5 mg/ml
form  A crystalline solid
color  White to off-white
InChI InChI=1S/C13H11N3O2/c17-12-4-2-1-3-11(12)9-15-16-13(18)10-5-7-14-8-6-10/h1-9,17H,(H,16,18)
InChIKey VBIZUNYMJSPHBH-UHFFFAOYSA-N
SMILES C1=NC=CC(C(NN=CC2=CC=CC=C2O)=O)=C1
CAS DataBase Reference 495-84-1(CAS DataBase Reference)

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