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Cas Database

Name	Androstanolone 17-benzoate	EINECS	213-891-8
CAS No.	1057-07-4	Density	1.14 g/cm³
PSA	43.37000	LogP	5.82380
Solubility	N/A	Melting Point	155 °C
Formula	C₂₆H₃₄O₃	Boiling Point	505.6 °C at 760 mmHg
Molecular Weight	394.554	Flash Point	216.7 °C
Transport Information	N/A	Appearance	N/A
Safety	36/37	Risk Codes	63
Molecular Structure		Hazard Symbols	Xn
Synonyms	5a-Androstan-3-one, 17b-hydroxy-, benzoate(6CI,7CI,8CI);5a-Dihydrotestosteronebenzoate;Androstanolone benzoate;Dihydrotestosterone benzoate;Ermalone;Hermalone;NSC 69549;Sarcosan;	Article Data	8

Androstanolone 17-benzoate Synthetic route

: 521-18-6
Stanolone

: 98-88-4
benzoyl chloride

: 1057-07-4
stanolone benzoate

Conditions

Conditions	Yield
In pyridine at 60℃; for 2h;	96%

: 6242-26-8
3β-Hydroxy-17β-benzoyloxy-5α-androstan

: 1057-07-4
stanolone benzoate

Conditions

Conditions	Yield
With 4-Benzoylpyridine In acetone at 20℃; for 46h; UV-irradiation; Inert atmosphere;	76%

17β-benzoyloxy-5α-androstanol-(3α): 17β-benzoyloxy-5α-androstanol-(3α)

: 1057-07-4
stanolone benzoate

Conditions

Conditions	Yield
With chromic acid; acetic acid

: C10H9FeCONHNH3(1+)*Cl(1-)={C10H9FeCONHNH3}Cl

: 1057-07-4
stanolone benzoate

: C10H9FeC27H35N2O3

Conditions

Conditions	Yield
In ethanol; acetic acid boiling;	84%
In ethanol; acetic acid

: ferrocenylcarbonylhydrazine

: 1057-07-4
stanolone benzoate

: C10H9FeC27H35N2O3

Conditions

Conditions	Yield
In ethanol; acetic acid boiling;	84%
In ethanol; acetic acid

: 120-72-9
indole

: 1057-07-4
stanolone benzoate

: 74252-30-5
2-(indol-3-yl)dihydrotestosterone benzoate

Conditions

Conditions	Yield
With perchloric acid In N,N-dimethyl-formamide for 3h; Heating;	72%

: 1057-07-4
stanolone benzoate

A: 26128-31-4
5α-hydroxy-3-oxo-5α-androstan-17β-yl benzoate

B: 6α-hydroxy-3-oxo-5α-androstan-17β-yl benzoate

Conditions

Conditions	Yield
With iodosylbenzene; 5,10,15,20-tetrakis-5-(2,2'-bi-Py)porphyrin Mn(III) chloride; copper(II) bis(trifluoromethanesulfonate) In water; acetonitrile at 20℃; for 16h;	A 36% B 45%

: 1057-07-4
stanolone benzoate

: 91-56-5
indole-2,3-dione

: Benzoic acid (5S,8R,9S,10S,13S,14S,17S)-2-(3-hydroxy-2-oxo-2,3-dihydro-1H-indol-3-yl)-10,13-dimethyl-3-oxo-hexadecahydro-cyclopenta[a]phenanthren-17-yl ester

Conditions

Conditions	Yield
With diethylamine In ethanol Heating;	30%

: 13050-38-9
benzilic hydrazide

: 1057-07-4
stanolone benzoate

: benzilic acid-(17β-benzoyloxy-5α-androstan-3-ylidenehydrazide)

Conditions

Conditions	Yield
With methanol; acetic acid

: 1057-07-4
stanolone benzoate

: 75-16-1
methylmagnesium bromide

A: 2233-69-4
3β-methyl-5α-androstane-3α,17β-diol

B: 2066-31-1
3α-methyl-5α-androstane-3β,17β-diol

Conditions

Conditions	Yield
With diethyl ether

Androstanolone 17-benzoate Specification

The cas register number of Androstanolone 17-benzoate is 1057-07-4. It also can be called as 5a-Androstan-17b-ol-3-one benzoate and the IUPAC Name about this chemical is [(5S,8R,9S,10S,13S,14S,17S)-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl] benzoate. It belongs to the Steroids.

Physical properties about Androstanolone 17-benzoate are: (1)ACD/LogP: 6.67; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 6.67; (4)ACD/LogD (pH 7.4): 6.67; (5)ACD/BCF (pH 5.5): 68566.73; (6)ACD/BCF (pH 7.4): 68566.73; (7)ACD/KOC (pH 5.5): 100755.93; (8)ACD/KOC (pH 7.4): 100755.93; (9)#H bond acceptors: 3; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 43.37 Å²; (12)Index of Refraction: 1.569; (13)Molar Refractivity: 113.07 cm³; (14)Molar Volume: 345.1 cm³; (15)Polarizability: 44.82x10^-24cm³; (16)Surface Tension: 46.2 dyne/cm; (17)Enthalpy of Vaporization: 77.53 kJ/mol; (18)Vapour Pressure: 2.4E-10 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical has possible risk of harm to the unborn child. When you are using it, wear suitable protective clothing and gloves.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C5C[C@@H]4CC[C@@H]3[C@H](CC[C@]2(C)[C@@H](OC(=O)c1ccccc1)CC[C@H]23)[C@@]4(C)CC5
(2)InChI: InChI=1/C26H34O3/c1-25-14-12-19(27)16-18(25)8-9-20-21-10-11-23(26(21,2)15-13-22(20)25)29-24(28)17-6-4-3-5-7-17/h3-7,18,20-23H,8-16H2,1-2H3/t18-,20-,21-,22-,23-,25-,26-/m0/s1
(3)InChIKey: ZGDZDAPCWHIIKB-LVYWIKMTBA
(4)Std. InChI: InChI=1S/C26H34O3/c1-25-14-12-19(27)16-18(25)8-9-20-21-10-11-23(26(21,2)15-13-22(20)25)29-24(28)17-6-4-3-5-7-17/h3-7,18,20-23H,8-16H2,1-2H3/t18-,20-,21-,22-,23-,25-,26-/m0/s1
(5)Std. InChIKey: ZGDZDAPCWHIIKB-LVYWIKMTSA-N

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