69427-46-9

Name 13-CIS-ACITRETIN
CAS 69427-46-9
Molecular Formula C21H26O3
MDL Number MFCD00870444
Molecular Weight 326.433
MOL File 69427-46-9.mol
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Chemical Properties

Appearance Yellow Solid
Melting point  190-193°C
Boiling point  521.3±38.0 °C(Predicted)
density  1.051±0.06 g/cm3(Predicted)
storage temp.  Amber Vial, -80°C Freezer
solubility  Chloroform (Slightly)
form  neat
pka 4.75±0.33(Predicted)
Stability: Light Sensitive, Temperature Sensitive
Major Application pharmaceutical (small molecule)
InChI 1S/C21H26O3/c1-14(8-7-9-15(2)12-21(22)23)10-11-19-16(3)13-20(24-6)18(5)17(19)4/h7-13H,1-6H3,(H,22,23)/b9-7+,11-10+,14-8+,15-12-
InChIKey IHUNBGSDBOWDMA-UGOGCBOOSA-N
SMILES O(C)c1c(c(c(c(c1)C)\C=C\C(=C\C=C\C(=C/C(=O)O)\C)\C)C)C

Safety Data

WGK Germany  WGK 3
HS Code  2918992090
Storage Class 11 - Combustible Solids

Hazard Information

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