Androsta-1,4-dien-3,17-dion
10,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-dione
Grundinformationen
- CAS
897-06-3- Standard-SMILES
CC12C=CC(=O)C=C1CCC1C2CCC2(C)C(=O)CCC12- InChIKey
LUJVUUWNAPIQQI-UHFFFAOYSA-N- Summenformel
- C19H24O2
- Durchschnittliche Molmasse
- 284,4 g/mol
Überblick
10,13-Dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-dione is a 3-hydroxy steroid. It has a role as an androgen.
Namen und Bezeichner
- Bevorzugter Name
- 10,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-dione
- IUPAC
- 10,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-dione
- Lokaler Name
- Androsta-1,4-dien-3,17-dion
- Englischer Name
- Androsta-1,4-diene-3,17-dione
- Summenformel
- C19H24O2
- Molmasse
- 284.39
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
897-06-3- PubChem CID
- 2192
- ChEMBL
CHEMBL8512- ChEBI
CHEBI:182567
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 3
- Polarare Oberfläche (TPSA)
- 34,1 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 0
- Schwere Atome
- 21
- Formalladung
- 0
- Komplexität
- 584
Physikochemische Eigenschaften
- Schmelzpunkt
- 138 · 138-139 °C(lit.)
- Siedepunkt
- 434.2 · 434.2±45.0 °C(Predicted)
- Dichte
- 1.14 · 1.14±0.1 g/cm3(Predicted)
- Dampfdruck
- 0 Pa · 0Pa at 20℃
- storage temp.
- Refrigerator
- Löslichkeit
- 50 mg/ml; · DMF: 50 mg/ml; DMF:PBS(pH 7.2)(1:1): 0.5 mg/ml; DMSO: 30 mg/ml; Ethanol: 5 mg/ml
- Aggregatzustand
- A crystalline solid
- Wasserlöslichkeit
- 430 mg/L · 430mg/L at 20℃
- Major Application
- pharmaceutical
- InChI
- 1S/C19H24O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h7,9,11,14-16H,3-6,8,10H2,1-2H3/t14-,15-,16-,18-,19-/m0/s1
- InChIKey
- LUJVUUWNAPIQQI-QAGGRKNESA-N
- SMILES
- [H][C@@]12CCC3=CC(=O)C=C[C@]3(C)[C@@]1([H])CC[C@]4(C)C(=O)CC[C@@]24[H]
- LogP
- 2.2 at · 2.2 at 25℃
- CAS Datenbank
- 897 · 897-06-3(CAS DataBase Reference)
Sicherheit und Regulatorisches
Sicherheitsdaten
- wgk
- 3
- hs_code
- 29372900
- RTECS-Nr.
- BV7988000
- risk_code
- 20/21/22-36/37/38
- hazard_code
- Xn
- safety_code
- 26-36
- Speicherklasse
- 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
- Hazard Classifications
- Aquatic Chronic 2Carc. 2Lact.Repr. 1B
- DEA Controlled Substances
- CSCN: 4000CAS SCH: ⅢNARC: N
Chemie und Industrie
Anwendungen
BeschreibungAndrosta-1,4-diene-3,17-dione (Item No. 24081) is an analytical reference standard categorized as an anabolic androgenic steroid. Androsta-1,4-diene-3,17-dione is a precursor in the synthesis of boldenone and has been used to enhance athletic performance. Androsta-1,4-diene-3,17-dione is regulated as a Schedule III compound in the United States. This product is intended for research and forensic applications.
VerwendenBoldenone related steroid; anabolic androgenic steroid
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Ergänzende Hinweise
DefinitionChEBI: A steroid that consists of androstane having double bonds at positions 1 and 4 and two keto groups at positions 3 and 17.
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