3',4'-Hexestrol Quinone
[CAS# 100551-58-4]

Identification

• Name: 3',4'-Hexestrol Quinone
• Synonyms: 4-[(1R,2S)-1-Ethyl-2-(4-Hydroxyphenyl)Butyl]-1,2-Benzoquinone; 4-[(1R,2S)-1-Ethyl-2-(4-Hydroxyphenyl)Butyl]-O-Benzoquinone; 3',4'-Hexestrol Quinone
• Molecular Formula: C₁₈H₂₀O₃
• Molecular Weight: 284.35
• CAS Registry Number: 100551-58-4
• SMILES: [C@H](C1=CC(=O)C(=O)C=C1)([C@@H](C2=CC=C(O)C=C2)CC)CC
• InChI: 1S/C18H20O3/c1-3-15(12-5-8-14(19)9-6-12)16(4-2)13-7-10-17(20)18(21)11-13/h5-11,15-16,19H,3-4H2,1-2H3/t15-,16+/m1/s1
• InChIKey: WHMZTZNMIAVTOD-CVEARBPZSA-N