ジニコナゾール

Diclopentezol

HCID 91738

基本情報

CAS: 70217-36-6
標準SMILES: CC(C)(C)C(O)C(=Cc1ccc(Cl)cc1Cl)n1cncn1
InChIKey: FBOUIAKEJMZPQG-UHFFFAOYSA-N
分子式: C15H17Cl2N3O
平均分子量: 326.2 g/mol
単同位体質量: 325.07486752

概要

Diniconazole is a conazole fungicide used to control a range of diseases including mildew, bunts and smuts systemically with curative and protective action. It also inhibits the demethylation of steroids distrupting ergosterol biosynthesis.

名称と識別子

優先名称: Diclopentezol
IUPAC: 1-(2,4-dichlorophenyl)-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pent-1-en-3-ol
現地名: ジニコナゾール
英語名: diniconazole
分子式: C15H17Cl2N3O
分子量: 326.22

名称と別名

Diclopentezol1-(2,4-dichlorophenyl)-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pent-1-en-3-olC15H17Cl2N3ORac-diniconazole76714-88-01H-1,2,4-Triazole-1-ethanol,b-[(2,4-dichlorophenyl)methylene]-a-(1,1-dimethylethyl)-, (E)-SCHEMBL21286SCHEMBL23066866DTXSID10273920FBOUIAKEJMZPQG-UHFFFAOYSA-NAKOS0302286191H-1,2,4-Triazole-1-ethanol, .beta.-[(2,4-dichlorophenyl)methylene]-.alpha.-(1,1-dimethylethyl)-, (.beta.E)-

名称をさらに表示

Ene listed(EZ)-DiniconazoleDiniconazole (Z/E isomers)α-tert-butyl-β-(2,4-dichlorophenylmethylene)-1h-1,2,4-triazole-1-ethanol1H-1,2,4-Triazole-1-ethanol, β-[(2,4-dichlorophenyl)methylene]-α-(1,1-dimethylethyl)-Diclopentezol, α-tert-Butyl-β-(2,4-dichlorophenylmethylene)-1H-1,2,4-triazole-1-ethanol1H-1,2,4-Triazole-1-ethanol, beta-((2,4-dichlorophenyl)methylene)-alpha-(1,1-dimethylethyl)-

1-(2,4-dichlorophenyl)-2-(1,2,4-triazol-1-yl)-4,4-dimethyl-1-penten-3-ol1H-1,2,4-Triazole-1-ethanol, ss-[(2,4-dichlorophenyl)methylene]-a-(1,1-dimethylethyl)-; ss-[(2,4-Dichlorophenyl)methylene]-a-(1,1-dimethylethyl)-1H-1,2,4-triazole-1-ethanol; Diclopentezol; 1-(2,4-Dichlorophenyl)-4,4-dimethyl-2-(1,2,4-triazol-1-yl)-1-penten-3-ol; (EZ)-Diniconazole

データベース識別子

CAS: 70217-36-6
PubChem CID: 91738
DTXSID: DTXSID10273920
EC Number: 688-588-0

物性

構造計算による物性

XLogP: 4.2
極性表面積: 50.9 Å²
水素結合供与体数: 1
水素結合受容体数: 3
回転可能結合数: 4
重原子数: 21
形式電荷: 0
複雑度: 384

物理化学的性質

沸点: 501.1 · 501.1±60.0 °C(Predicted)
比重(密度): 1.27 · 1.27±0.1 g/cm3(Predicted)
闪点: 150 °C · 150 °C
酸解離定数(Pka): 13.46 · 13.46±0.20(Predicted)
BRN: 9202976 · 9202976

安全と法規制

GHS分類

GHS Classification · 3 件

Warning

H302: Harmful if swallowed [Warning Acute toxicity, oral]

P264, P270, P273, P301+P317, P330, P391, and P501 (click each P-code to see the statement)

危険有害性情報

Hazard Classes and CategoriesAcute toxicity - category 4

毒性情報

Carcinogen ClassificationNo indication of carcinogenicity to humans (not listed by IARC).

安全データ

wgk: 3
rtecs: XZ4803550
ridadr: UN 3077 9 / PGIII
risk_code: 22-50/53
hazard_code: Xn,N
safety_code: 60-61

化学と産業

用途と製造

UsesThis is a man-made compound that is used as a pesticide.

サプライヤー25 社

陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]

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江苏艾康生物医药研发有限公司025-025-66113011 15955137747 · [email protected]

郑州鸿晟医药科技有限公司0371-55695890 15637198702 · [email protected]

毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]

化合物ノート

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