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Hexestrol

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For Research Use Only | Not For Clinical Use
CATAPS84162
CAS84-16-2
Structure
MDL NumberMFCD00068996
SynonymsSinestrol, meso-3,4-Di(p-hydroxyphenyl)-n-hexane, Synoestrol, Extra-Plex, Phenol, 4,4'-[(1R,2S)-1,2-diethyl-1,2-ethanediyl]bis-, rel-, Hexoestrol, Syntrogene, meso-Hexestrol, Cycloestrol, Hexron, Mesohexestrol, Synestrol, Phenol, 4,4'-(1,2-diethylethylene)di-, meso- (8CI), Erythrohexestrol, Hexestrol, Hormoestrol,Phenol, 4,4'-(1,2-diethyl-1,2-ethanediyl)bis-, (R*,S*)-, Hexestrofen, Estrifar, Synthovo, meso-3,4-Bis(p-hydroxyphenyl)-n-hexane, Hexanoestrol, NSC 9894, Estronal
IUPAC Name4-[(3S,4R)-4-(4-hydroxyphenyl)hexan-3-yl]phenol
Molecular Weight270.37
Molecular FormulaC18H22O2
EC Number201-518-1
Canonical SMILESCC[C@H]([C@H](CC)c1ccc(O)cc1)c2ccc(O)cc2
InChIInChI=1S/C18H22O2/c1-3-17(13-5-9-15(19)10-6-13)18(4-2)14-7-11-16(20)12-8-14/h5-12,17-20H,3-4H2,1-2H3/t17-,18+
InChI KeyPBBGSZCBWVPOOL-HDICACEKSA-N
REAXYS Number3209460
Accurate Mass270.162
FormatNeat
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