ethyl 4'-hydroxy-[1,1'-biphenyl]-4-carboxylate

Synonyms: "Ethyl 4'-hydroxy-[1,1'-biphenyl]-4-carboxylate", "ethyl 4'-hydroxy[1,1'-biphenyl]-4-carboxylate", "Ethyl 4-(4-hydroxyphenyl)benzoate", "Ethyl 4'-hydroxy-4-biphenylcarboxylate", "4-(4-Ethoxycarbonylphenyl)phenol", "ethyl 4'-hydroxybiphenyl-4-carboxylate", "ethylhydroxybiphenylcarboxylate", "4-(4-hydroxyphenyl)benzoate ethylester".

Source: Ethyl 4'-hydroxy-[1,1'-biphenyl]-4-carboxylate is used in the synthesis of polyester.

Identifiers:

IUPAC Name: ethyl 4-(4-hydroxyphenyl)benzoate
CAS Number: 50670-76-3
PubChem ID: 4049156
InChiKey: FYXQIMAAEMCZLV-UHFFFAOYSA-N
Canonical SMILES: CCOC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)O

Structural Properties:

Molecular Formula: C₁₅H₁₄O₃
Molecular Weight: 242.274

Pharmacophore Features:

Number of bond donors: 1
Number of bond acceptors: 3
Number of atoms different from hydrogen: 18

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Schultz TW, Sinks GD, Cronin MTD. 2000. Effect of substituent size and dimensionality on potency of phenolic xenoestrogens evaluated with a recombinant yeast assay. Environ Toxicol Chem 19(11):2637-2642. DOI: 10.1002/etc.5620191104. URL: http://onlinelibrary.wiley.com/doi/10.1002/etc.5620191104/abstract.