4185-01-7

Name 12-ALPHA-HYDROXY-3-OXO-5-BETA-CHOLANOICACID
CAS 4185-01-7
Molecular Formula C24H38O4
MDL Number MFCD00271399
Molecular Weight 390.56
MOL File 4185-01-7.mol
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Chemical Properties

Melting point  >105°C (dec.)
Boiling point  545.9±35.0 °C(Predicted)
density  1.124±0.06 g/cm3(Predicted)
storage temp.  -20°C Freezer, Under inert atmosphere
solubility  Chloroform (Slightly), Methanol (Slightly)
form  Solid
pka 4.76±0.10(Predicted)
color  White to Off-White
InChIKey WMUMZOAFCDOTRW-COERZIJBNA-N
SMILES [C@@]12([H])CC[C@]3([H])CC(=O)CC[C@]3(C)[C@@]1([H])C[C@H](O)[C@]1(C)[C@H](CC[C@@]21[H])[C@H](C)CCC(=O)O |&1:0,4,11,13,16,18,20,23,25,r|

Safety Data

WGK Germany  WGK 3
Storage Class 11 - Combustible Solids

Hazard Information

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