CAS No.566-19-8,7-Keto-dehydroepiandrosterone Suppliers

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Basic Information

Molecular Structure:
CAS No.:	566-19-8
Name:	7-Keto-dehydroepiandrosterone
Article Data:	30
Cas Database

Formula:	C₁₉H₂₆O₃
Molecular Weight:	302.414
Synonyms:	Androst-5-ene-7,17-dione,3b-hydroxy- (8CI);3b-Hydroxy-5-androstene-7,17-dione;5-Androsten-3b-ol-7,17-dione;7-Keto-DHEA;7-Oxo-DHEA;Androst-5-ene-7,17-dione,3-hydroxy-, (3b)-;
EINECS:	1592732-453-0
Density:	1.19 g/cm³
Melting Point:	240.0-244.0oC
Boiling Point:	477.1 °C at 760 mmHg
Flash Point:	256.5 °C
Appearance:	White powder
PSA:	54.37000
LogP:	3.05820

Synthetic route

: 53-43-0
dehydroepiandrosterone

: 566-19-8
5-androstene-3β-ol-7,17-dione

Conditions

Conditions	Yield
With tert.-butylhydroperoxide; N-hydroxyphthalimide; cobalt(II) acetate In acetone at 20℃; for 5h; regioselective reaction;	81.1%
With N-hydroxyphthalimide; sodium dichromate; chromium(III) perchlorate In acetone at 20℃; for 48h; Product distribution / selectivity;	74.25%
With tert.-butylhydroperoxide; dirhodium(II) tetrakis(caprolactam) In water; 1,2-dichloro-ethane at 40℃; for 20h;	74%

: 166173-97-3
(3S,8R,9S,10R,13S,14S)-3-hydroxy-10,13-dimethyl-1,3,4,8,9,10,11,12,13,14,15,16-dodecahydrospiro[cyclopenta[a]phenanthrene-17,2'-[1,3]dioxolan]-7(2H)-one

: 566-19-8
5-androstene-3β-ol-7,17-dione

Conditions

Conditions	Yield
With perchloric acid; water In acetone at 20℃; for 20h;	65%

: 53-43-0
dehydroepiandrosterone

A: 566-19-8
5-androstene-3β-ol-7,17-dione

B: 2487-48-1, 7522-54-5, 62357-03-3, 53-00-9
3β,7α-dihydroxyandrost-5-ene-17-one

C: 2487-48-1
5-androsten-3β,7β-diol-17-one

Conditions

Conditions	Yield
With Mortierella isabellina AM212 fungal strain for 12h; Enzymatic reaction;	A 6% B 53.5% C 24%
With Absidia coerulea AM93 In acetone at 20℃; for 8h; Time; Enzymatic reaction;	A 5.5% B 22% C 49%

...Expand

: 7745-40-6, 14456-21-4
3β-hydroxy-17,17-ethylenedioxo-5-androstene

: 566-19-8
5-androstene-3β-ol-7,17-dione

Conditions

Conditions	Yield
With CrO3/NHPI on activated clay In dichloromethane at 20℃;	40%

: 853-23-6
prasterone acetate

A: 566-19-8
5-androstene-3β-ol-7,17-dione

B: 2487-48-1, 7522-54-5, 62357-03-3, 53-00-9
3β,7α-dihydroxyandrost-5-ene-17-one

C: 2487-48-1
5-androsten-3β,7β-diol-17-one

D: 58211-52-2
3β,14α-dihydroxyandrost-5-en-7,17-dione

Conditions

Conditions	Yield
With Cunninghamella elegans In ethanol for 72h; Further byproducts given;	A 5.4% B 26.8% C 9% D 1.1%
With Cunninghamella elegans In ethanol for 72h; Further byproducts given;	A 5.4% B 26.8% C 9% D 1.1%

...Expand

: 53-43-0
dehydroepiandrosterone

A: 566-19-8
5-androstene-3β-ol-7,17-dione

B: 2487-48-1, 7522-54-5, 62357-03-3, 53-00-9
3β,7α-dihydroxyandrost-5-ene-17-one

C: 2487-48-1
5-androsten-3β,7β-diol-17-one

D: 3β,7β-dihydroxy-5β,6β-epoxyandrostan-17-one

E: 3β,4β,7β-trihydroxyandrost-5-en-17-one

F: 3β,7α-dihydroxy-5β,6β-epoxyandrostan-17-one

G: 3β,4β,7α-trihydroxyandrost-5-en-17-one

Conditions

Conditions	Yield
With Ulocladium chartarum MRC 72584 In water; N,N-dimethyl-formamide at 28℃; for 120h; Enzymatic reaction;	A 6% B 12% C 16% D 3% E 4% F 2% G 3%

...Expand

: 853-23-6
prasterone acetate

A: 566-19-8
5-androstene-3β-ol-7,17-dione

B: 2487-48-1
5-androsten-3β,7β-diol-17-one

C: 58324-06-4
5,6β-epoxy-3β,12α-dihydroxy-5β-androstan-17-one

D: 58211-52-2
3β,14α-dihydroxyandrost-5-en-7,17-dione

Conditions

Conditions	Yield
With Cunninghamella elegans In ethanol for 72h; Further byproducts given;	A 5.4% B 9% C 4.1% D 1.1%

...Expand

: 853-23-6
prasterone acetate

: 1189-85-1
di-tert-butyl chromate

: 566-19-8
5-androstene-3β-ol-7,17-dione

Conditions

Conditions	Yield
und anschliessend Hydrolysieren;

: 853-23-6
prasterone acetate

: 566-19-8
5-androstene-3β-ol-7,17-dione

Conditions

Conditions	Yield
With chromium(VI) oxide und anschliessend Hydrolysieren;

: 1449-61-2
3-O-acetyl-7-oxo-dehydroepiandrosterone

: 566-19-8
5-androstene-3β-ol-7,17-dione

Conditions

Conditions	Yield
With sodium carbonate In methanol
With sodium hydrogencarbonate In methanol	307 mg

Raw Materials

853-23-6

53-43-0

Downstream Products

Total:191 Page 1 of 6 1 2 3 4 5 6 Next>>

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Specification

7-Keto-dehydroepiandrosterone has the IUPAC Name of (3S,8R,9S,10R,13S,14S)-3-Hydroxy-10,13-dimethyl-2,3,4,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-7,17-dione. With the CAS NO.566-19-8, it is also called 7-Keto DHEA; 7-Oxo-DHEA; DHEA, 7-keto-; UNII-2334LJD2E9; 3beta-Hydroxyandrost-5-ene-7,17-dione. 7-Oxodehydroepiandrosterone (CAS NO.566-19-8) is used as a pharmaceutical intermediates.

Physical properties about 7-Keto-dehydroepiandrosterone are: (1)ACD/LogP: 1.669; (2)ACD/LogD (pH 5.5): 1.67; (3)ACD/LogD (pH 7.4): 1.67; (4)ACD/BCF (pH 5.5): 10.93 ; (5)ACD/BCF (pH 7.4): 10.93; (6)ACD/KOC (pH 5.5): 192.76; (7)ACD/KOC (pH 7.4): 192.76; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 1; (11)Index of Refraction: 1.569; (12)Molar Refractivity: 83.229 cm³; (13)Molar Volume: 253.886 cm³; (14)Polarizability: 32.995 10-24cm³; (15)Surface Tension: 48.1559982299805 dyne/cm; (16)Density: 1.191 g/cm³; (17)Flash Point: 256.478 °C; (18)Enthalpy of Vaporization: 85.408 kJ/mol; (19)Boiling Point: 477.144 °C at 760 mmHg

You can still convert the following datas into molecular structure:
(1)InChI=1S/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-/m0/s1;
(2)InChIKey=KPRGOTLNGIBVFL-GINZOMEDSA-N;
(3)SmilesC1[C@@H](CC2=CC([C@H]3[C@@H]4CCC([C@@]4(C)CC[C@H]3[C@@]2(C1)C)=O)=O)O;