Hexaconazole

Hexaconazole

Names
Systematic IUPAC name 2-(2,4-Dichlorophenyl)-1-(1H-1,2,4-triazol-1-yl)hexan-2-ol
Identifiers
CAS Number	79983-71-4 Y
3D model (Jmol)	Interactive image Interactive image
Beilstein Reference	8328399
ChemSpider	59833 Y 21173802 (S) Y
ECHA InfoCard	100.101.232
EC Number	413-050-7
KEGG	C18466 Y
MeSH	Hexaconazole
PubChem	66461 37888330 (R) 37888329 (S)
RTECS number	XZ4803200
UNII	SX9R3X1FQV Y
UN number	3077
InChI 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 Y Key: STMIIPIFODONDC-UHFFFAOYSA-N Y
SMILES CCCCC(O)(Cn1cncn1)c1ccc(Cl)cc1Cl CCCCC(O)(CN1C=NC=N1)C1=CC=C(Cl)C=C1Cl
Properties[1]
Chemical formula	C14H17Cl2N3O
Molar mass	314.21 g·mol−1
Appearance	White crystalline solid
Melting point	111 °C (232 °F; 384 K)
Hazards
GHS pictograms
GHS signal word	Warning
GHS hazard statements	H302, H317, H411
GHS precautionary statements	P273, P280
EU classification (DSD)	Xn N
R-phrases	R22, R43, R51/53
S-phrases	S24, S37, S61
Lethal dose or concentration (LD, LC):
LD50 (median dose)	6071 mg/kg (oral, female rat)[1]
Except where otherwise noted, data are given for materials in their standard state (at 25 °C [77 °F], 100 kPa).
Infobox references

Hexaconazole is a systemic fungicide used for the control of many fungi particularly Ascomycetes and Basidiomycetes.

External links

• Hexaconazole in the Pesticide Properties DataBase (PPDB)

References