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2243-06-3

Basic Information
CAS No.: 2243-06-3
Name: Androst-4-ene-3,6,17-trione
Article Data: 50
Molecular Structure:
Molecular Structure of 2243-06-3 (Androst-4-ene-3,6,17-trione)
Formula: C19H24O3
Molecular Weight: 300.398
Synonyms: 4-Androstenetriol;
EINECS: 200-589-5
Density: 1.188 g/cm3
Melting Point: 223-224 °C
Boiling Point: 460.044 °C at 760 mmHg
Flash Point: 198.465 °C
Appearance: Yellow solid
PSA: 51.21000
LogP: 3.26640
Synthetic route
103232-92-4

4α-ethylthio-5α-androstane-3,6,17-trione

2243-06-3

androst-4-ene-3,6,17-trione

Conditions
ConditionsYield
With 3-chloro-benzenecarboperoxoic acid In ethyl acetate for 9h; Ambient temperature;90%
53-43-0

dehydroepiandrosterone

2243-06-3

androst-4-ene-3,6,17-trione

Conditions
ConditionsYield
With Montmorillonite K10; pyridinium chlorochromate In 1,4-dioxane for 0.75h; Irradiation;89%
With chromium(VI) oxide; sulfuric acid In acetone at 0℃; modified Jones oxidation;85%
With Jones reagent83%
74395-56-5

5α-hydroxyandrostane-3,6,17-trione

2243-06-3

androst-4-ene-3,6,17-trione

Conditions
ConditionsYield
With sulfuric acid; water In ethanol for 3.5h; Reflux;89%
80%
With hydrogenchloride; chloroform

C19H26O4

2243-06-3

androst-4-ene-3,6,17-trione

Conditions
ConditionsYield
With sulfuric acid In ethanol for 5h; Concentration; Reflux;87%
19637-35-5

3-tetrahydropyran-2-yloxy-androst-5-en-17-one

2243-06-3

androst-4-ene-3,6,17-trione

Conditions
ConditionsYield
With 3 A molecular sieve; pyridinium chlorochromate In benzene for 5h; Heating;86%
24704-84-5

6α-hydroxy-androst-4-ene-3,17-dione

2243-06-3

androst-4-ene-3,6,17-trione

Conditions
ConditionsYield
With potassium hydroxide; tetrazolium blue In ethanol Heating;85%
With potassium hydroxide; tetrazolium blue In ethanol at 25 - 50℃; Rate constant; rate constants for enolisation and oxidation;
63-05-8

Androstenedione

2243-06-3

androst-4-ene-3,6,17-trione

Conditions
ConditionsYield
With tert.-butylhydroperoxide; Rh2(cap)4 In 1,2-dichloro-ethane at 40℃; for 16h; Product distribution / selectivity; Allylic oxidation;80%
With tert.-butylhydroperoxide; [Rh2(cap)4*2CH3CN] In water; 1,2-dichloro-ethane at 40℃; for 40h;80%
With tert.-butylhydroperoxide; Rh2(cap)4 In water at 40℃; for 16h; Product distribution / selectivity; Allylic oxidation;62%
103232-93-5

6-methoxy-4,6-androstadiene-3,17-dione

2243-06-3

androst-4-ene-3,6,17-trione

Conditions
ConditionsYield
With hydrogenchloride In dichloromethane for 72h; Ambient temperature;73%
63-05-8

Androstenedione

A

6-hydroperoxyandrost-4-ene-3,17-dione

B

2243-06-3

androst-4-ene-3,6,17-trione

Conditions
ConditionsYield
With N-hydroxyphthalimide; 2,2’-azobis(4-methoxy-2,4-dimethyl)valeronitrile; oxygen In acetonitrile at 30℃; under 760 Torr; for 48h;A 56%
B 12%
25375-38-6

3-hydroxy-5-androsten-17-one

2243-06-3

androst-4-ene-3,6,17-trione

Conditions
ConditionsYield
With pyridinium chlorochromate In dichloromethane for 96h;53%
Downstream Products
571-92-6
1476-34-2
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Specification

The Androst-4-ene-3,6,17-trione with the cas number 2243-06-3 is also called (8R,9S,10R,13S,14S)-10,13-dimethyl-1,2,7,8,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthrene-3,6,17-trione. Its molecular formula is C19H24O3. This chemical belongs to the following product categories: (1)Steroids & Hormones - 13C & 2H; (2)Steroids. It is an aromatase inhibitor.

You can still convert the following datas into molecular structure:
(1)SMILES: C1(CC[C@@]2([C@H]3CC[C@@]4(C(CC[C@@H]4[C@@H]3CC(C2=C1)=O)=O)C)C)=O
(2)InChI: InChI=1/C19H24O3/c1-18-7-5-11(20)9-15(18)16(21)10-12-13-3-4-17(22)19(13,2)8-6-14(12)18/h9,12-14H,3-8,10H2,1-2H3/t12-,13-,14-,18+,19-/m0/s1