Testosterone decanoate

HCID 155143
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Basic information

CAS
5721-91-5
Standard SMILES
CCCCCCCCCC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
InChIKey
LBERVHLCXUMDOT-MPZZESAYSA-N
Molecular formula
C29H46O3
Average molar mass
442.7 g/mol
Monoisotopic mass
442.34469533

Overview

Testosterone decanoate is a steroid ester.

Names & identifiers

Preferred name
Testosterone decanoate
IUPAC
[(8R,9S,10R,13S,14S,17S)-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl] decanoate
English name
Testosterone decanoate
Molecular formula
C29H46O3
Molecular weight
442.67

Names & synonyms

Testosterone decanoate5721-91-5DTXSID5046198IJW60LAO6S17beta-Hydroxyandrost-4-en-3-one decanoateNSC-26642[(8R,9S,10R,13S,14S,17S)-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl] decanoateDTXCID3026198((8R,9S,10R,13S,14S,17S)-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta(a)phenanthren-17-yl) decanoateTestosterone, decanoateRefChem:896637227-226-4
Show more names
testosterone caproateTesto decanoateTestosterone DecanoaTestosterone DecanoatTestostrone decanoateTestosterone DecaonateTestosateronedecanoatetestosterone 17β-decanoateTestosterone Decanoate(TD)
NCGC00160513-01Testosterone 17-DecanoateAndrost-4-en-3-one, 17-[(1-oxodecyl)oxy]-, (17b)-(8R,9S,10R,13S,14S,17S)-10,13-dimethyl-3-oxo-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl decanoateUNII-IJW60LAO6STestosterone 17-Decanoate (1.0mg/ml in Acetonitrile)Test DecanoateTestosterondecanoat

Database identifiers

CAS
5721-91-5
PubChem CID
155143
DTXSID
DTXSID5046198
ChEMBL
CHEMBL1473654
ChEBI
CHEBI:35000
UNII
IJW60LAO6S
EC Number
227-226-4
Nikkaji
J225.117E

Properties

Computed structural properties

XLogP
8
Topological polar surface area
43.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
10
Heavy atoms
32

Experimental & physicochemical properties

DrugsPharmaceuticals -> Synthetic Cannabinoids or Psychoactive Compounds
Human DrugsPharmaceuticals
Endocrine DisruptorsPotential endocrine disrupting compound

Physicochemical properties

Melting point
38 °C · 38 °C
Boiling point
539.2 · 539.2±50.0 °C(Predicted)
Density
1.04 · 1.04±0.1 g/cm3(Predicted)
solubility
Practically insoluble in water, very soluble in acetone, in methylene chloride and in anhydrous ethanol, freely soluble in fatty oils.
InChIKey
LBERVHLCXUMDOT-MPZZESAYSA-N
SMILES
[C@@]12([H])CCC3=CC(=O)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@H](CC[C@@]21[H])OC(=O)CCCCCCCCC |&1:0,10,12,16,18,21,r|

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H302 (96.6%): Harmful if swallowed [Warning Acute toxicity, oral]

P203, P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P318, P321, P330, P362+P364, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 58 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Regulatory InformationTestosterone decanoate: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Other Safety InformationIMAP assessments - Androst-4-en-3-one, 17-[(1-oxodecyl)oxy]-, (17.beta.)-: Environment tier I assessment
Hazard Classes and CategoriesAcute Tox. 4 (96.6%)

Safety data

wgk
3
risk_code
20/21/22-40
Signal word
Warning
Symbol(GHS)
GHS07,GHS08,GHS09
hazard_code
Xn
safety_code
22-36

Chemistry & industry

Uses & manufacturing

Use ClassificationPharmaceuticals
Applications · 2 items

DescriptionTestosterone Decanoate is one of the many esterified forms of testosterone and is a long form of the testosterone as it offers a long half life after administration. This is actually an androgen and anabolic steroid and a testosterone ester, a potent long acting injectable male synthetic hormone. Testosterone Decanoate is second longest acting form of testosterone after Testosterone Undecanoate. As with any other form of testosterone, the only difference between them is in the half life (the release time of the hormone after it got administered).

UsesTestosterone decanoate is an androgen that mainly used by men to maintain the second sexual sign, sexual desire and male psychology. It is an steroid indicated for testosterone replacement therapy in sterilization, missing testicle, hypopituitarism, and osteoporosis.

Upstream & downstream products

Suppliers100 total

Shanghai Biolang Biotechnology Co., Ltd.+86-15970428662 +86-13397199602 · [email protected]
艾吉析科技（上海）有限公司17717235263 · [email protected]
INTATRADE GmbH+49 3493/605464 · [email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
普善实业（陕西）有限公司029-81310890 18165209495 · [email protected]

Additional notes

DefinitionChEBI: Testosterone decanoate is a steroid ester.

Related reactions

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Compound notes

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