| Identification | Back Directory | [Name]
ESTRONE-2,4,16,16-D4 | [CAS]
53866-34-5 | [Synonyms]
Estrogen-d4
Crystogen-d4
Wynestron-d4
Aquacrine-d4
Crinovaryl-d4
WAY 164397-d4
Cristallovar-d4
Deuterated estrone
ESTRONE-2,4,16,16-D4
Deuterated folliculin
ESTRONE-2,4,16,16-D4 99+%
ESTRONE-2,4,16,16-D4, 95 ATOM % D
1,3,5(10)-Estratrien-3-ol-17-one-d4
Estrone-D4 IN ACETONITRILE 100 μG/ML
Estrone-d4 (Estriol EP Impurity B-d4)
3-Hydroxy-17-keto-estra-1,3,5-triene-d4
3-Hydroxyestra-1,3,5(10)-trien-17-one-d4
3-Hydroxy-1,3,5(10)-estratrien-17-one-D4
Estra-1,3,5(10)-trien-17-one-2,4,16,16-d4, 3-hydroxy-
(8R,9S,13S,14S)-2,4,16,16-tetradeuterio-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-17-one | [Molecular Formula]
C18H18D4O2 | [MDL Number]
MFCD01074157 | [MOL File]
53866-34-5.mol | [Molecular Weight]
274.39 |
| Chemical Properties | Back Directory | [Melting point ]
258-260 °C(lit.) | [storage temp. ]
-20°C Freezer | [solubility ]
Chloroform (Slightly, Heated), DMSO (Sparingly), Ethanol (Slightly, Sonicated) | [form ]
Solid | [color ]
White to Pale Orange | [Optical Rotation]
[α]20/D +161°, c = 1 in dioxane | [InChI]
1S/C18H22O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-16,19H,2,4,6-9H2,1H3/t14-,15-,16+,18+/m1/s1/i3D,7D2,10D | [InChIKey]
DNXHEGUUPJUMQT-QSPUTOQOSA-N | [SMILES]
[2H]c1cc2[C@H]3CC[C@@]4(C)[C@@H](CC([2H])([2H])C4=O)[C@@H]3CCc2c([2H])c1O | [CAS Number Unlabeled]
53-16-7 |
| Safety Data | Back Directory | [Hazard Codes ]
T | [Risk Statements ]
60-61-45 | [Safety Statements ]
53-22-36/37/39-45 | [WGK Germany ]
3 | [HS Code ]
28459000 | [Storage Class]
6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects | [Hazard Classifications]
Carc. 2
Lact.
Repr. 1A |
| Hazard Information | Back Directory | [Chemical Properties]
White Solid | [Uses]
A labelled metabolite of 17β-Estradiol. | [Uses]
Isotope labelled Estrone (E889050), which is a metabolite of 17β-Estradiol (E888000). During the metabolism, it is in rapid equilibrium with Estriol (E888960) and 17β-Estradiol (E888000) (1). Causes the feminization of male fish at human and animal waste sites (2).Drinking water contaminant candidate list 3 (CCL 3) compound as per United States Environmental Protection Agency (EPA), environmental, and food contaminants. |
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