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Chemical synthesis

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  1. Bisphenol A, Antagonist of Androgen receptor;Agonist of Estrogen receptor-β
    Cas Number: 80-05-7        EC Number: 201-245-8
    Formula:  C15H16O2        Molecular Weight: 228.29
    IUPAC Name:  4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
    SMILES:  CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O
    InChIKey: IISBACLAFKSPIT-UHFFFAOYSA-N
    InChI:  InChI=1S/C15H16O2/c1-15(2,11-3-7-13(16)8-4-11)12-5-9-14(17)10-6-12/h3-10,16-17H,1-2H3
    Synonyms: 2,2-Bis(4-hydroxyphenyl)propane | 4,4'-Isopropylidenediphenol
  2. n-Octanol
    Cas Number: 111-87-5        EC Number: 203-917-6, 271-642-9, 606-925-1
    Formula:  C8H18O        Molecular Weight: 130.23
    IUPAC Name:  octan-1-ol
    SMILES:  CCCCCCCCO
    InChIKey: KBPLFHHGFOOTCA-UHFFFAOYSA-N
    InChI:  InChI=1S/C8H18O/c1-2-3-4-5-6-7-8-9/h9H,2-8H2,1H3
    Synonyms: AI3-02169 | O0212 | OCTYL ALCOHOL [FCC] | Alcohol C8 | Alcohol C-8 | Dytol M-83 | Heptyl carbinol | 1-OCTANOL [FHFI] ...
  3. n-Octanol
    Cas Number: 111-87-5        EC Number: 203-917-6, 271-642-9, 606-925-1
    Formula:  C8H18O        Molecular Weight: 130.23
    IUPAC Name:  octan-1-ol
    SMILES:  CCCCCCCCO
    InChIKey: KBPLFHHGFOOTCA-UHFFFAOYSA-N
    InChI:  InChI=1S/C8H18O/c1-2-3-4-5-6-7-8-9/h9H,2-8H2,1H3
    Synonyms: AI3-02169 | O0212 | OCTYL ALCOHOL [FCC] | Alcohol C8 | Alcohol C-8 | Dytol M-83 | Heptyl carbinol | 1-OCTANOL [FHFI] ...
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