489204
Estrone-2,4,16,16-d4
95 atom % D
Synonym(s):
1,3,5(10)-Estratrien-3-ol-17-one-D4, 3-Hydroxy-1,3,5(10)-estratrien-17-one-D4, Deuterated estrone, Deuterated folliculin
About This Item
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isotopic purity
95 atom % D
Quality Level
form
solid
optical activity
[α]20/D +161°, c = 1 in dioxane
technique(s)
mass spectrometry (MS): suitable
mp
258-260 °C (lit.)
mass shift
M+4
SMILES string
[2H]c1cc2[C@H]3CC[C@@]4(C)[C@@H](CC([2H])([2H])C4=O)[C@@H]3CCc2c([2H])c1O
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
InChI key
DNXHEGUUPJUMQT-QSPUTOQOSA-N
Related Categories
Packaging
Signal Word
Danger
Hazard Statements
Precautionary Statements
Hazard Classifications
Carc. 2 - Lact. - Repr. 1A
Storage Class Code
6.1C - Combustible, acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects
WGK
WGK 3
Flash Point(F)
Not applicable
Flash Point(C)
Not applicable
Certificates of Analysis (COA)
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