Identification Chemical Properties Safety Data Hazard Information Supplier

1391054-68-4

Name 4-[(3,5-Di-tert-butyl-2-hydroxyphenylthio)isopropylidenethio]-2,6-di-tert-butylphenol
CAS 1391054-68-4
Molecular Formula C31H48O2S2
MDL Number MFCD28369369
Molecular Weight 516.84
MOL File 1391054-68-4.mol
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Chemical Properties

Boiling point  539.7±50.0 °C(Predicted)
density  1.07±0.1 g/cm3(Predicted)
pka 10.56±0.50(Predicted)
Major Application pharmaceutical (small molecule)
InChI InChI=1S/C31H48O2S2/c1-27(2,3)19-15-21(28(4,5)6)26(33)24(16-19)35-31(13,14)34-20-17-22(29(7,8)9)25(32)23(18-20)30(10,11)12/h15-18,32-33H,1-14H3
InChIKey JFBAVBRCJKPJRP-UHFFFAOYSA-N
SMILES C1(O)=C(C(C)(C)C)C=C(C(C)(C)C)C=C1SC(SC1=CC(C(C)(C)C)=C(O)C(C(C)(C)C)=C1)(C)C

Safety Data

WGK Germany  WGK 3
HS Code  2930902000
Storage Class 11 - Combustible Solids

Hazard Information

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