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82799-44-8

Name 2,4-Diethyl-9H-thioxanthen-9-one
CAS 82799-44-8
EINECS(EC#) 280-041-0
Molecular Formula C17H16OS
MDL Number MFCD00082910
Molecular Weight 268.37
MOL File 82799-44-8.mol
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Chemical Properties

Melting point  66-70 °C (lit.)
Boiling point  427.9±45.0 °C(Predicted)
density  1.178±0.06 g/cm3(Predicted)
vapor pressure  0Pa at 25℃
storage temp.  Keep in dark place,Inert atmosphere,2-8°C
form  powder to crystal
color  Light yellow to Yellow to Orange
Water Solubility  8μg/L at 25℃
InChI InChI=1S/C17H16OS/c1-3-11-9-12(4-2)17-14(10-11)16(18)13-7-5-6-8-15(13)19-17/h5-10H,3-4H2,1-2H3
InChIKey BTJPUDCSZVCXFQ-UHFFFAOYSA-N
SMILES C1(=O)C2=C(C=CC=C2)SC2=C1C=C(CC)C=C2CC
LogP 6.5 at 20℃
CAS DataBase Reference 82799-44-8(CAS DataBase Reference)
EPA Substance Registry System 82799-44-8(EPA Substance)

Safety Data

Safety Statements 
WGK Germany  3
HS Code  29349990

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