855871
Mestranol
99%
Synonym(s):
(17α)-3-Methoxy-19-norpregna-1,3,5(10)-trien-20-yn-17-ol, 17α-Ethynyl-1,3,5(10)-estratriene-3,17β-diol 3-methyl ether, 17α-Ethynylestradiol 3-methyl ether, 3-Methoxy-17α-ethynylestradiol, NSC 84032
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About This Item
Quality Segment
assay
99%
form
solid
optical activity
[α]15/D +3°, c = 2 in dioxane
mp
153-155 °C (lit.)
functional group
hydroxyl
SMILES string
COc1ccc2C3CC[C@@]4(C)C(CC[C@@]4(O)C#C)C3CCc2c1
InChI
1S/C21H26O2/c1-4-21(22)12-10-19-18-7-5-14-13-15(23-3)6-8-16(14)17(18)9-11-20(19,21)2/h1,6,8,13,17-19,22H,5,7,9-12H2,2-3H3/t17-,18-,19+,20+,21+/m1/s1
InChI key
IMSSROKUHAOUJS-MJCUULBUSA-N
Gene Information
human ... ESR1(2099)
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signalword
Warning
hcodes
Hazard Classifications
Carc. 2 - Eye Irrit. 2 - Skin Irrit. 2
Storage Class
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
Eyeshields, Gloves, type P3 (EN 143) respirator cartridges
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