134404-52-7

Name Seocalcitol
CAS 134404-52-7
Molecular Formula C30H46O3
MDL Number MFCD00871599
Molecular Weight 454.68
MOL File 134404-52-7.mol

Chemical Properties

Melting point  123-125°
Boiling point  608.5±55.0 °C(Predicted)
density  1.06±0.1 g/cm3(Predicted)
storage temp.  Store at -20°C
solubility  Soluble in DMSO
form  solid
pka 14.29±0.29(Predicted)
color  White
InChIKey LVLLALCJVJNGQQ-QMWUBLQMSA-N
SMILES C[C@@]12[C@](CC[C@]2([H])[C@@H](/C=C/C=C/C(CC)(O)CC)C)([H])/C(CCC1)=C/C=C3C[C@@H](O)C[C@H](O)C/3=C

Safety Data

WGK Germany  WGK 3
Storage Class 11 - Combustible Solids
Hazard Classifications Aquatic Chronic 4

Hazard Information

Supplier