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566-19-8

Name 7-Keto-dehydroepiandrosterone
CAS 566-19-8
EINECS(EC#) 1592732-453-0
Molecular Formula C19H26O3
MDL Number MFCD00198500
Molecular Weight 302.41
MOL File 566-19-8.mol
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Chemical Properties

Melting point  245-248 °C
Boiling point  477.1±45.0 °C(Predicted)
density  1.19±0.1 g/cm3(Predicted)
solubility  DMF: 25 mg/ml; DMF:PBS(pH 7.2)(1:1): 0.5 mg/ml; DMSO: 15 mg/ml; Ethanol: 10 mg/ml
form  A crystalline solid
pka 14.67±0.60(Predicted)
InChI InChI=1/C19H26O3/c1-18-7-5-12(20)9-11(18)10-15(21)17-13-3-4-16(22)19(13,2)8-6-14(17)18/h10,12-14,17,20H,3-9H2,1-2H3/t12-,13-,14-,17-,18-,19-/s3
InChIKey KPRGOTLNGIBVFL-YQJRJXGQNA-N
SMILES C[C@]12CC[C@H](O)CC1=CC(=O)[C@@]1([H])[C@]3([H])CCC(=O)[C@@]3(C)CC[C@]21[H] |&1:1,4,11,13,19,23,r|
CAS DataBase Reference 566-19-8(CAS DataBase Reference)

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