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481-18-5

Name A-SPINASTEROL
CAS 481-18-5
EINECS(EC#) 200-258-5
Molecular Formula C29H48O
MDL Number MFCD00200554
Molecular Weight 412.69
MOL File 481-18-5.mol

Chemical Properties

Melting point  168-169°
alpha  D25 -3.6° (c = 2.8 in chloroform)
Boiling point  500.0±44.0 °C(Predicted)
density  0.98±0.1 g/cm3(Predicted)
storage temp.  2-8°C
solubility  Chloroform (Slightly), Ethyl Acetate (Slightly, Heated), Methanol (Slightly, Heated)
form  Solid
pka 15.10±0.70(Predicted)
color  White to Off-White
biological source Aster scaber
Stability: Light Sensitive
InChIKey JZVFJDZBLUFKCA-RGDZLSLNNA-N
SMILES C12=CC[C@@]3([H])C[C@@H](O)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@H](CC[C@@]21[H])[C@H](C)/C=C/[C@@H](CC)C(C)C |&1:3,6,10,12,16,18,21,23,27,r|

Safety Data

WGK Germany  WGK 3
Storage Class 11 - Combustible Solids

Hazard Information

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