640-79-9

Name Glycochenodeoxycholic Acid
CAS 640-79-9
Molecular Formula C26H43NO5
MDL Number MFCD00271498
Molecular Weight 449.62
MOL File 640-79-9.mol

Chemical Properties

Boiling point  655.6±40.0 °C(Predicted)
density  1.162±0.06 g/cm3(Predicted)
storage temp.  Store at -20°C
solubility  DMSO : ≥ 29 mg/mL (64.50 mM)
form  Solid
pka 3.58±0.10(Predicted)
color  White to off-white
InChIKey GHCZAUBVMUEKKP-VHGKAQQHNA-N
SMILES C(O)(=O)CNC(=O)CC[C@@H](C)[C@@H]1[C@]2(CCC3[C@]4(C)[C@]([H])(C[C@@H](O)C3C2CC1)C[C@H](O)CC4)C |&1:9,11,12,16,18,21,28,r|

Safety Data

Symbol(GHS)  Flame (GHS02)Skull and Crossbones (GHS06)Health Hazard (GHS08)
GHS02,GHS06,GHS08
Signal word  Danger
Hazard statements  H225-H301+H311+H331-H370
Precautionary statements  P210-P240-P241-P242-P243-P260-P264-P270-P271-P280-P301+P310-P321-P330-P303+P361+P353-P304+P340-P307+P311-P312-P361+P364-P370+P378-P403+P233-P403+P235-P405-P501
WGK Germany  WGK 3
Storage Class 11 - Combustible Solids

Hazard Information

Supplier