4-(diethylamino)benzaldehyde

Synonyms: "4-diethylaminobenzaldehyde", "p-(diethylamino)benzaldehyde"

Source: 4-(dimethylamino)benzaldehyde is used in Ehrlich's reagent for spectrophotometric determination of hydrazine as it reacts to form azo dyes. It is also used for determination of urine bilirubin and porphobilinogen.

Identifiers:

IUPAC Name: 4-(diethylamino)benzaldehyde
CAS Number: 120-21-8
PubChem ID: 67114
InChiKey: MNFZZNNFORDXSV-UHFFFAOYSA-N
Canonical SMILES: CCN(CC)C1=CC=C(C=C1)C=O

Structural Properties:

Molecular Formula: C11H15NO
Molecular Weight: 177,2429

Pharmacophore Features:

Number of bond donors: 0
Number of bond acceptors: 2
Number of atoms different from hydrogen: 13

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Toxicological Information

ACToR (Aggregated Computational Toxicology Resource)

CTD (Comparative Toxicogenomics Database)

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


Akahori Y, Nakai M, Yamasaki K, Takatsuki M, Shimohigashi Y, Ohtaki M. 2008. Relationship between the results of in vitro receptor binding assay to human estrogen receptor alpha and in vivo uterotrophic assay: Comparative study with 65 selected chemicals. Toxicol in Vitro 22(1):225-231.

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