hexaconazole

Synonyms: "hexaconazol", "contaf", "sitara", "anvil", "chlortriafol"

Source: hexaconazole is a broad-spectrum, systemic fungicide with eradicant and protectant activity against a wide range of plant pathogens.

Identifiers:

IUPAC Name: 2-(2,4-dichlorophenyl)-1-(1,2,4-triazol-1-yl)hexan-2-ol
CAS Number: 79983-71-4
PubChem ID: 66461
InChiKey: STMIIPIFODONDC-UHFFFAOYSA-N
Canonical SMILES: CCCCC(CN1C=NC=N1)(C2=C(C=C(C=C2)Cl)Cl)O

Structural Properties:

Molecular Formula: C14H17Cl2N3O
Molecular Weight: 314,21028

Pharmacophore Features:

Number of bond donors: 1
Number of bond acceptors: 3
Number of atoms different from hydrogen: 20

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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


Trosken ER, Adamska M, Arand M, Zarn JA, Patten C, Volkel W, Lutz WK. 2006. Comparison of lanosterol-14 alpha-demethylase (CYP51) of human and Candida albicans for inhibition by different antifungal azoles. Toxicology 228(1):24-32.

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