3-phenoxybenzaldehyde

Synonyms: "3-phenoxybenzaldehyde", "3-phenoxy-benzaldehyde", "m-phenoxybenzaldehyde", "3-formyldiphenyl ether", "m-(phenyloxy)benzaldehyde", "3-phenoxy benzaldehyde", "5-phenoxybenzaldehyde", "m-phenoxy-benzaldehyde", "meta-phenoxybenzaldehyde", "3-(phenoxy)benzaldehyde", "meta-phenoxy-benzaldehyde".

Source: 3-phenoxybenzaldehyde is a major metabolite from pyrethroids.

Identifiers:

IUPAC Name: 3-phenoxybenzaldehyde
CAS Number: 39515-51-0
PubChem ID: 38284
InChiKey: MRLGCTNJRREZHZ-UHFFFAOYSA-N
Canonical SMILES: C1=CC=C(C=C1)OC2=CC=CC(=C2)C=O

Structural Properties:

Molecular Formula: C₁₃H₁₀O₂
Molecular Weight: 198.221

Pharmacophore Features:

Number of bond donors: 0
Number of bond acceptors: 2
Number of atoms different from hydrogen: 15

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Evidence Supporting This Chemical as an Endocrine Disruptor
TEDX List of Potential Endocrine Disruptors

McCarthy AR, Thomson BM, Shaw IC, Abell AD. 2006. Estrogenicity of pyrethroid insecticide metabolites. J Environ Monit 8(1):197-202. DOI: 10.1039/B511209E . URL: http://pubs.rsc.org/-/content/articlehtml/2006/em/b511209e.