112076-61-6

Name DEOXYCHOLIC-2,2,4,4-D4 ACID
CAS 112076-61-6
Molecular Formula C24H40O4
MDL Number MFCD00209707
Molecular Weight 392.58
MOL File 112076-61-6.mol

Chemical Properties

Melting point  171-174 °C
Fp  9℃
storage temp.  -20°C
solubility  DMSO (Slightly), Ethanol (Slightly, Sonicated), Methanol (Slightly)
form  Solid
color  White to Off-White
InChIKey KXGVEGMKQFWNSR-FCSCGBJGSA-N
SMILES [H][C@@]12[C@]([C@](CC([2H])([2H])[C@@H](O)C3([2H])[2H])(C)[C@]3([H])CC2)([H])C[C@H](O)[C@@]4(C)[C@@]1([H])CC[C@]4([H])[C@]([H])(C)CCC(O)=O
CAS Number Unlabeled 83-44-3

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-P260-P280-P301+P310+P330-P308+P311-P403+P233
Hazard Codes  Xn
Risk Statements 
Safety Statements 
RIDADR  UN1230 - class 3 - PG 2 - Methanol, solution
WGK Germany  3
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral

Hazard Information

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