フルアジホップ-P-ブチル標準品

Fluazifop-p-butyl

HCID 3033674
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基本情報

CAS
79241-46-6
標準SMILES
CCCCOC(=O)[C@@H](C)Oc1ccc(Oc2ccc(C(F)(F)F)cn2)cc1
InChIKey
VAIZTNZGPYBOGF-CYBMUJFWSA-N
分子式
C19H20F3NO4
平均分子量
383.4 g/mol
単同位体質量
383.13444278

概要

Fluazifop-P-butyl is a butyl 2-(4-{[5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propanoate that has R configutation. The active enantiomer of the herbicide fluazifop-butyl, it is used as a post-emergence herbicide for the control grass weeds in various broad-leaved crops. It has a role as a herbicide, an agrochemical and an EC 6.4.1.2 (acetyl-CoA carboxylase) inhibitor. It is functionally related to a fluazifop-P. It is an enantiomer of a (S)-fluazifop-butyl.

名称と識別子

優先名称
Fluazifop-p-butyl
IUPAC
butyl (2R)-2-[4-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenoxy]propanoate
現地名
フルアジホップ-P-ブチル標準品
英語名
Fluazifop-P-butyl
分子式
C19H20F3NO4
分子量
383.36

名称と別名

FLUAZIFOP-P-BUTYL79241-46-6Fusilade superFusilade IIFusilade 2000Fusilade SFusilade DXFusilade 5PP005 2E HerbicideFluazifop-P-butyl [ISO]Fluazifop-P butyl esterPP 005
名称をさらに表示
フルアジホップ-P-ブチル標準品フルアジホップ‐P‐ブチル標準品CS_N-11979-100MG_フルアジホップ-P-ブチルフルアジホップ-P-ブチルフルアジホプ-P-ブチル STANDARDフルアジホプ-P-ブチルフルアジホプ-P-ブチル Standard, 100 µg/mL in MeOH(R)-2-[4-[5-(トリフルオロメチル)-2-ピリジルオキシ]フェノキシ]プロパン酸ブチルフルアジホップP-ブチルフシラードスーパーブチル (2R)-2-(4-{[5-(トリフルオロメチル)ピリジン-2-イル]オキシ}フェノキシ)プロパノアートSuperFUSILADEWINNERPpooqpp005SL 263VENTUREORNAMECOncide-Pfusilade5
EPA Pesticide Chemical Code 122809N99K0AJ91SFUSILADE FORTEbutyl (2R)-2-(4-{[5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propanoateButyl (R)-2-[4-(5-trifluoromethyl-2-pyridyloxy)phenoxy]propionateCHEBI:132964Butyl (R)-2-(4-(5-trifluoromethyl)-2-pyridyloxy)phenoxypropionate(+)-Fluazifop-butyl

データベース識別子

CAS
79241-46-6
PubChem CID
3033674
DTXSID
DTXSID0034855
ChEMBL
CHEMBL1864569
ChEBI
CHEBI:132964
UNII
N99K0AJ91S
EC Number
616-669-2
Nikkaji
J491.291H

物性

構造計算による物性

XLogP
4.5
極性表面積
57.7 Ų
水素結合供与体数
0
水素結合受容体数
8
回転可能結合数
9
重原子数
27

実験および物理化学的性質

Pesticides · 2 件

Environmental transformation -> Pesticides (parent, predecessor)

Pesticide (Fluazifop-P-butyl) -> USDA PDB

LogP4.5
Collision Cross Section · 3 件

194.5 Ų [M+Na]+ [CCS Type: DT; Buffer gas: N2; Ionization: ESI+; Dataset: TOXCAST; Source Identifier: DTXSID0034855]

194.8 Ų [M+H]+ [CCS Type: TW]

196.88 Ų [M+H]+

物理化学的性質

融点
5 °C · 5°C
沸点
164 °C · 164°C (0.02 mm Hg)
比重(密度)
1.21 · 1.21
闪点
50 °C · >50 °C
貯蔵温度
0 · 0-6°C
溶解性
100 mg/mL · DMSO: 100 mg/mL (260.85 mM)

化学的性質

化学的特性light yellow liquid

安全と法規制

GHS分類

GHS Classification · 6 件

Warning

H361d ***: Suspected of damaging the unborn child [Warning Reproductive toxicity]

P203, P273, P280, P318, P391, P405, and P501 (click each P-code to see the statement)

Warning

H226 (20.1%): Flammable liquid and vapor [Warning Flammable liquids]

P203, P210, P233, P240, P241, P242, P243, P261, P272, P273, P280, P302+P352, P303+P361+P353, P318, P321, P333+P317, P362+P364, P370+P378, P391, P403+P235, P405, and P501 (click each P-code to see the statement)

危険有害性情報

Regulatory Information · 3 件

Regulation (EC) No 1107/2009 (amended)

Fluazifop-P-Butyl is listed in the dataset of EPA Human Health Benchmarks for Pesticides under the Safe Drinking Water Act (40 eCFR 141)

Fluazifop-P-butyl: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Hazard Classes and Categories · 3 件

Flam. Liq. 3 (20.1%)

Reproductive toxicity - category 2

Repr. 2

毒性情報

Carcinogen ClassificationNo indication of carcinogenicity to humans (not listed by IARC).
RAIS Toxicity Values · 4 件

0.5

OPP

0.0051

OPP

EPA Human Health Benchmarks for Pesticides · 6 件

Fluazifop-P-Butyl

0.5

3000

Children

0.0051

30

安全データ

wgk
3
rtecs
UA2950000
ridadr
UN3082 9/PG 3
hs_code
29333990
risk_code
50/53-63
消防法
危-4-3-III

化学と産業

用途と製造

UsesThis is a man-made compound that is used as a pesticide.
Household ProductsInformation on 22 consumer products that contain Fluazifop-p-butyl in the following categories is provided:
Use ClassificationEnvironmental transformation -> Pesticides (parent, predecessor)

上流・下流製品情報

サプライヤー8 社

陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
上海毕楷科技有限公司18516304666
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
上海一研生物科技有限公司021-69985186 13611928337 · [email protected]
潍坊市伟蒙化工有限公司QQ 1340191485 15105445095 · [email protected]
補足説明 · 1 件

定義ChEBI: A butyl 2-(4-{[5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propanoate that has R configutation. The active enantiomer of the herbicide fluazifop-butyl, it is used as a post-emergence herbicide for the control grass weeds in various broad-l aved crops.

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