3'-Hydroxyhexestrol
4-[(3R,4S)-4-(4-hydroxyphenyl)hexan-3-yl]benzene-1,2-diol
Also Known As: 3'-Hydroxyhexestrol|(1R,1 S)-4-Hydroxyhexestrol|1,2-benzenediol,4-(1-ethyl-2-, -|1,2-Benzenediol,4-(1-ethyl-2- -, -|4-[(3r,4s)-4-(4-hydroxyphenyl)hexan-3-yl]benzene-1,2-diol|4-[4-(4-hydroxyphenyl)hexan-3-yl]benzene-1,2-diol|(alphaR,betaS)-alpha,beta-Diethylbibenzyl-3,4,4 -triol|1,2-Benzenediol, 4-(1-ethyl-2-(4-hydroxyphenyl)butyl)-, (R*,S*)-|4-((3R,4S)-4-(4-hydroxyphenyl)hexan-3-yl)benzene-1,2-diol|(r*,s*)-4-(1-ethyl-2-(4-hydroxyphenyl)butyl)-1,2-benzenediol|Rel-4-((3R,4S)-4-(4-hydroxyphenyl)hexan-3-yl)benzene-1,2-diol|4-[(alphaR,betaS)-alpha,beta-Diethyl-4-hydroxyphenethyl]pyrocatechol
| Molecular Formula | C18H22O3 |
|---|---|
| Molecular Weight | 286.1569 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 60.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 286.1569 |
| Monoisotopic Mass | 286.1569 |
| Heavy Atoms | 21 |
| Complexity | 299.0 |
Chemical Identifiers
| CAS Number | 87004-89-5 |
|---|---|
| SMILES | CC[C@H](C1=CC=C(C=C1)O)[C@@H](CC)C2=CC(=C(C=C2)O)O |
| InChIKey | KWYPVFQNTRXTSH-CVEARBPZSA-N |
Product Overview
3'-Hydroxyhexestrol (CAS 87004-89-5), with molecular formula C18H22O3 and molecular weight 286.1569 g/mol. IUPAC: 4-[(3R,4S)-4-(4-hydroxyphenyl)hexan-3-yl]benzene-1,2-diol.
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