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Estradiene dione-3-keta Structure

Estradiene dione-3-keta

Chemical Properties

Melting point 152-154°C
Boiling point 488.1±45.0 °C(Predicted)
Density  1.20±0.1 g/cm3(Predicted)
vapor pressure  0Pa at 25℃
storage temp.  Sealed in dry,Room Temperature
solubility  Chloroform (Sparingly, Heated, Sonicated), Methanol (Slightly)
form  Solid
color  White to Light Yellow
Water Solubility  903μg/L at 25℃
InChI InChI=1/C20H26O3/c1-19-8-6-15-14-7-9-20(22-10-11-23-20)12-13(14)2-3-16(15)17(19)4-5-18(19)21/h6,16-17H,2-5,7-12H2,1H3/t16-,17+,19+/s3
InChIKey XUOQKQRMICQUQC-GDJQEYATNA-N
SMILES C[C@@]12C(CC[C@@]1([H])[C@]1([H])CCC3CC4(OCCO4)CCC=3C1=CC2)=O |&1:1,5,7,r|
LogP 4.74

Safety

Symbol(GHS)
Signal wordDanger
Hazard statements H360-H373-H411
Precautionary statements P201-P202-P260-P273-P280-P308+P313-P391-P405-P501
RIDADR  3077
HS Code  2937.23.5050
HazardClass  9
PackingGroup  III
NFPA 704:
0
2 0

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