U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry RACEMIC
Molecular Formula C14H17Cl2N3O
Molecular Weight 314.21
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HEXACONAZOLE

SMILES

CCCCC(O)(CN1C=NC=N1)C2=CC=C(Cl)C=C2Cl

InChI

InChIKey=STMIIPIFODONDC-UHFFFAOYSA-N
InChI=1S/C14H17Cl2N3O/c1-2-3-6-14(20,8-19-10-17-9-18-19)12-5-4-11(15)7-13(12)16/h4-5,7,9-10,20H,2-3,6,8H2,1H3

HIDE SMILES / InChI

Molecular Formula C14H17Cl2N3O
Molecular Weight 314.21
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

PubMed

PubMed

TitleDatePubMed
Comparison of osteoblast and cardiomyocyte differentiation in the embryonic stem cell test for predicting embryotoxicity in vivo.
2014-09
A high-throughput screen for teratogens using human pluripotent stem cells.
2014-01
Thyroid endocrine disruption in zebrafish larvae following exposure to hexaconazole and tebuconazole.
2013-08-15
Inhibitory effects of azole-type fungicides on interleukin-17 gene expression via retinoic acid receptor-related orphan receptors α and γ.
2012-03-15
Transcriptomic concentration-response evaluation of valproic acid, cyproconazole, and hexaconazole in the neural embryonic stem cell test (ESTn).
2012-02
Discriminating classes of developmental toxicants using gene expression profiling in the embryonic stem cell test.
2011-03-05
Reducing the impact of pesticides on biological control in Australian vineyards: pesticide mortality and fecundity effects on an indicator species, the predatory mite Euseius victoriensis (Acari: Phytoseiidae).
2010-12
Acute human lethal toxicity of agricultural pesticides: a prospective cohort study.
2010-10-26
Microwave synthesis and antifungal evaluations of some chalcones and their derived diaryl-cyclohexenones.
2010-08
Coupling stir bar sorptive extraction-dispersive liquid-liquid microextraction for preconcentration of triazole pesticides from aqueous samples followed by GC-FID and GC-MS determinations.
2010-06
Descriptive and mechanistic toxicity of conazole fungicides using the model test alga Dunaliella tertiolecta (Chlorophyceae).
2010-06
Synthesis of nalidixic acid based hydrazones as novel pesticides.
2010-03-10
Solarization and biosolarization enhance fungicide dissipation in the soil.
2010-03
Synthesis and bioefficacy evaluation of new 3-substituted-3,4-dihydro-1,3-benzoxazines.
2010-02
Optoelectronic capillary sensors in microfluidic and point-of-care instrumentation.
2010
Photocatalytic degradation of eight pesticides in leaching water by use of ZnO under natural sunlight.
2009-12-30
Contribution of leaf growth on the disappearance of fungicides used on tea under South Indian agroclimatic conditions.
2009-06
Synthesis and pesticidal activity of new N-alkyl-N-[1-(2-hydroxyphenyl) ethyl]amines.
2009-05
Enantiomer separation of triazole fungicides by high-performance liquid chromatography.
2009-04
Development and validation of a multiresidue method for determination of 82 pesticides in water using GC.
2009-02
Cyclodextrin-modified MEKC for enantioseparation of hexaconazole, penconazole, and myclobutanil.
2009-02
Human poisoning with hexastar: a hexaconazole-containing agrochemical fungicide.
2008-08
Comparative effects of different triazole compounds on antioxidant metabolism of Solenostemon rotundifolius.
2008-04-01
Genotoxic action of fungicide Conan 5FL (hexaconazole) on mammalian cells in vivo and in vitro.
2008-03
Gas chromatographic method for the determination of hexaconazole residues in black tea.
2008-02
Determination of hexaconazole in surface water samples from river and the sea by liquid chromatography-electrospray tandem mass spectrometry.
2008-01
Comparative effects of different triazole compounds on growth, photosynthetic pigments and carbohydrate metabolism of Solenostemon rotundifolius.
2007-11-15
Differential effects of hexaconazole and paclobutrazol on biomass, electrolyte leakage, lipid peroxidation and antioxidant potential of Daucus carota L.
2007-11-15
Changes in antioxidant potential and sink-organ dry matter with pigment accumulation induced by hexaconazole in Plectranthus forskholii Briq.
2007-11
Changes in carbohydrate metabolism by triazole growth regulators in cassava (Manihot esculenta Crantz); effects on tuber production and quality.
2007-09
Determination of pesticides in water by cone-shaped membrane protected liquid phase microextraction prior to micro-liquid chromatography.
2007-06-08
Chiral separations of pesticide enantiomers by high-performance liquid chromatography using cellulose triphenylcarbamate chiral stationary phase.
2007-01-27
Comparison of lanosterol-14 alpha-demethylase (CYP51) of human and Candida albicans for inhibition by different antifungal azoles.
2006-11-10
Comparative enantioseparation of seven triazole fungicides on (S,S)-Whelk O1 and four different cellulose derivative columns.
2006-08
In vitro selection of an effective fungicide against Armillaria mellea and control of white root rot of grapevine in the field.
2006-03
Determination of 22 triazole compounds including parent fungicides and metabolites in apples, peaches, flour, and water by liquid chromatography/tandem mass spectrometry.
2006-01-03
Stereoselective kinetic study of hexaconazole enantiomers in the rabbit.
2005-05-05
Direct enantiomeric resolutions of chiral triazole pesticides by high-performance liquid chromatography.
2005-03-31
Mobility of four triazole fungicides in two Indian soils.
2005-02
High temperature liquid chromatography of triazole fungicides on polybutadiene-coated zirconia stationary phase.
2004-12-03
Evaluation of the systemic activity of simeconazole in comparison with that of other DMI fungicides.
2004-09
Chiral separation of some triazole pesticides by supercritical fluid chromatography.
2004-08-13
Evaluation of a method based on liquid chromatography/electrospray tandem mass spectrometry for analyzing eight triazolic and pyrimidine fungicides in extracts of processed fruits and vegetables.
2004-08-07
Triazole fungicide degradation in peaches in the field and in model systems.
2003-04
Simultaneous determination of pesticides using a four-band disposable optical capillary immunosensor.
2002-12-01
Uncertainty in measurements of dermal absorption of pesticides.
2002-12
Sorption behavior of triazole fungicides in Indian soils and its correlation with soil properties.
2002-10-23
Induction and inhibition of aromatase (CYP19) activity by various classes of pesticides in H295R human adrenocortical carcinoma cells.
2002-07-01
Simultaneous determination of six triazolic pesticide residues in apple and pear pulps by liquid chromatography with ultraviolet diode array detection.
2001-10-17
Development of a SPME-GC-ECD methodology for selected pesticides in must and wine samples.
2001-04
Patents
Substance Class Chemical
Created
by admin
on Mon Mar 31 21:52:30 GMT 2025
Edited
by admin
on Mon Mar 31 21:52:30 GMT 2025
Record UNII
SX9R3X1FQV
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ANVIL
Preferred Name English
HEXACONAZOLE
ISO   MI  
Common Name English
HEXACONAZOLE [MI]
Common Name English
(±)-HEXACONAZOLE
Common Name English
HEXACONAZOLE [ISO]
Common Name English
PLANETE
Brand Name English
PC-1002
Code English
PP-523
Code English
RS-2-(2,4-DICHLOROPHENYL)-1-(1H-1,2,4-TRIAZOL-1-YL)HEXAN-2-OL
Common Name English
HEXACONAZOLE, (±)-
Common Name English
R-154523
Code English
1H-1,2,4-TRIAZOLE-1-ETHANOL, .ALPHA.-BUTYL-.ALPHA.-(2,4-DICHLOROPHENYL)-
Systematic Name English
Code System Code Type Description
WIKIPEDIA
Hexaconazole
Created by admin on Mon Mar 31 21:52:30 GMT 2025 , Edited by admin on Mon Mar 31 21:52:30 GMT 2025
PRIMARY
FDA UNII
SX9R3X1FQV
Created by admin on Mon Mar 31 21:52:30 GMT 2025 , Edited by admin on Mon Mar 31 21:52:30 GMT 2025
PRIMARY
PUBCHEM
66461
Created by admin on Mon Mar 31 21:52:30 GMT 2025 , Edited by admin on Mon Mar 31 21:52:30 GMT 2025
PRIMARY
MERCK INDEX
m5987
Created by admin on Mon Mar 31 21:52:30 GMT 2025 , Edited by admin on Mon Mar 31 21:52:30 GMT 2025
PRIMARY Merck Index
EPA CompTox
DTXSID4034653
Created by admin on Mon Mar 31 21:52:30 GMT 2025 , Edited by admin on Mon Mar 31 21:52:30 GMT 2025
PRIMARY
CAS
79983-71-4
Created by admin on Mon Mar 31 21:52:30 GMT 2025 , Edited by admin on Mon Mar 31 21:52:30 GMT 2025
PRIMARY
ALANWOOD
hexaconazole
Created by admin on Mon Mar 31 21:52:30 GMT 2025 , Edited by admin on Mon Mar 31 21:52:30 GMT 2025
PRIMARY