99447-30-0

Name 25-hydroxyvitamin D3 3-sulfate ester
CAS 99447-30-0
Molecular Formula C27H44O5S
MDL Number MFCD28411439
Molecular Weight 480.7
MOL File 99447-30-0.mol
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Chemical Properties

density  1.14±0.1 g/cm3(Predicted)
storage temp.  -20°C
solubility  Methanol (Slightly), Water (Slightly)
form  Solid
pka -3.55±0.18(Predicted)
color  Pale Yellow to Dark Beige
Stability: Light Sensitive, Temperature Sensitive
Major Application detection
InChIKey UVFUTTRHHIQISA-DZAJWRDGSA-M
SMILES C[C@H](CCCC(C([2H])([2H])[2H])(C([2H])([2H])[2H])O)C1CCC([C@]1(C)CCC/2)C2=C\C=C(C[C@@H](OS(=O)([O-])=O)CC3)/C3=C.[Na+]

Safety Data

RIDADR  UN1170 - class 3 - PG 2 - Ethanol, solution
WGK Germany  WGK 1
Storage Class 3 - Flammable liquids
Hazard Classifications Eye Irrit. 2
Flam. Liq. 2

Hazard Information

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