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beta-Estradiol 17-acetate Structure

beta-Estradiol 17-acetate

Chemical Properties

Melting point 210 °C
Boiling point 450.5±45.0 °C(Predicted)
Density  1.18±0.1 g/cm3(Predicted)
storage temp.  -20°C Freezer, Under inert atmosphere
solubility  Chloroform (Sparingly), Ethyl Acetate (Slightly), Methanol (Slightly), DMSO (Slightly)
form  Solid
pka 10.26±0.60(Predicted)
color  White to Off-White
PH 6.96 at 24.1℃ and 10g/L
BRN  2625732
InChI 1S/C20H26O3/c1-12(21)23-19-8-7-18-17-5-3-13-11-14(22)4-6-15(13)16(17)9-10-20(18,19)2/h4,6,11,16-19,22H,3,5,7-10H2,1-2H3/t16-,17-,18+,19+,20+/m1/s1
InChIKey QAHOQNJVHDHYRN-SLHNCBLASA-N
SMILES CC(=O)O[C@H]1CC[C@H]2[C@@H]3CCc4cc(O)ccc4[C@H]3CC[C@]12C
LogP 4 at 25℃ and pH5

Safety Information

Hazard Codes  T
Risk Statements  60-61
Safety Statements  53-45
WGK Germany  3
Storage Class 6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
Hazard Classifications Aquatic Chronic 1
Repr. 1B

MSDS

Usage And Synthesis

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