CAS 55-38-9|methyl 3-methyl-4-(methylsulfanyl)phenyl methoxy(sulfanylidene)phosphonite|? Dimethoxy-[3-methyl-4-(methylthio)phenoxy]-thioxophosphorane|Fenthion|? <i>O,O</i>-Dimethyl <i>O</i>-4-methyl...

基本信息

化学结构

分子式

C₁₀H₁₅O₃PS₂

分子量

278.328061

精确质量

278.02002297

电荷

InChI

InChI=1S/C10H15O3PS2/c1-8-7-9(5-6-10(8)16-4)13-14(15,11-2)12-3/h5-7H,1-4H3

InChIKey

PNVJTZOFSHSLTO-UHFFFAOYSA-N

Canonic Smiles

CSc1ccc(cc1C)OP(=S)(OC)OC

Isomeric Smiles

S=P(OC)(OC)Oc1ccc(SC)c(c1)C

计算属性

JChem

LogD (pH = 7.4)

3.80

LogD (pH = 5.5)

3.80

Log P

3.80

可自由旋转的化学键

质子供体

质子受体

里宾斯基五规则

true

极化表面积

27.69

极化性

27.54

摩尔折射率

73.67

LOG S

-4.17

数据来源

名称和标识

IUPAC标准名

methyl 3-methyl-4-(methylsulfanyl)phenyl methoxy(sulfanylidene)phosphonite O,O-dimethyl O-3-methyl-4-(methylsulfanyl)phenyl phosphorothioate

别名

? Dimethoxy-[3-methyl-4-(methylthio)phenoxy]-thioxophosphoraneFenthion? O,O-Dimethyl O-4-methylthio-m-tolyl phosphorothioate? O,O-Dimethyl O-[3-methyl-4-(methylthio)phenyl] phosphorothioate倍硫磷FenthionO,O′-Dimethyl O″-[3-methyl-4-(methylthio)phenyl] thiophosphateO,O′-二甲基 O″-[3-甲基-4-(甲硫基)苯基]硫代磷酸酯BaycidPhosphorothioic Acid O,O-Dimethyl O-[3-Methyl-4-(methylthio)phenyl] EsterENT-25540O,O-Dimethyl O-[4-(Methylthio)-m-tolyl] thiophosphateMercaptophosBayer 29493O,O-Dimethyl O-4-(methylmercapto)-3-methylphenyl phosphorothioateMercaptophosfenthion4-Methylmercapto-3-methylphenyl dimethyl thiophosphateO,O-Dimethyl O-4-methylthio-m-tolyl phosphorothioateMPPPhosphorothioic acid, O,O-dimethyl O-(3-methyl-4-(methylthio)phenyl) esterO,O-dimethyl O-[3-methyl-4-(methylsulfanyl)phenyl] thiophosphateFenthionO,O-Dimethyl-O-4-(methylmercapto)-3-methylphenyl thiophosphate

IUPAC传统名

fenthion

名称和标识

数据登录号

化合物性质

理化性质

熔点

7°C

溶解度

54-56 ppm (at 20 °C) in water

soluble in glyceride oils, methanol, ethanol, ether, acetone, and most organic solvents, especially chlorinated hydrocarbons

沸点

87°C (at 0.01 mmHg)

外观

colorless, almost odorless liquid; 95-98% pure fenthion is a brown oily liquid with a weak garlic odor

密度

1.250 g/cm³ (at 20 °C / 4 °C)

蒸汽压

4 ? 10^-5 mmHg (at 20 °C)

闪点

>212 °F

>100 °C

产品相关信息

级别

PESTANAL®, analytical standard

analytical standard

Empirical Formula (Hill Notation)

C10H15O3PS2

包装

ampule of 250 mg

质检报告

下载链接

化合物性质

分子相关蛋白质

暂无数据

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分子图谱

暂无数据

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描述信息

Wikipedia

Fenthion

Sigma Aldrich

36552

法律信息
PESTANAL 注册商标 Sigma-Aldrich Laborchemikalien GmbH

TRC

F278000

Fenthion is an organothiophosphate used as an insecticide. Fenthion is also a potent acaricide.

ChEBI

CHEBI:34761

An organic thiophosphate that is O,O-dimethyl hydrogen phosphorothioate in which the hydrogen atom of the hydroxy group is replaced by a 3-methyl-4-(methylsulfanyl)phenyl group. It exhibits acaricidal and insecticidal activities.

描述信息

参考文献

PubChem文献

数据源提供

• Kyriakidis, N.V. et al.: Food Chem., 91, 241 (1984)

• Pati, B.R. et al.: Plant Soil, 80, 215 (1984)

• Barros, A.T. et al.: Vet. Parasitol., 96, 243 (1984)

参考文献

生物活性

PubChem BioAssay

生物活性

名称和标识

IUPAC标准名

methyl 3-methyl-4-(methylsulfanyl)phenyl methoxy(sulfanylidene)phosphonite O,O-dimethyl O-3-methyl-4-(methylsulfanyl)phenyl phosphorothioate

别名

IUPAC传统名

fenthion

描述信息

Wikipedia

Fenthion

Sigma Aldrich

36552

法律信息
PESTANAL 注册商标 Sigma-Aldrich Laborchemikalien GmbH

TRC

F278000

Fenthion is an organothiophosphate used as an insecticide. Fenthion is also a potent acaricide.

ChEBI

CHEBI:34761

参考文献

PubChem文献

数据源提供

• Kyriakidis, N.V. et al.: Food Chem., 91, 241 (1984)

• Pati, B.R. et al.: Plant Soil, 80, 215 (1984)

• Barros, A.T. et al.: Vet. Parasitol., 96, 243 (1984)

生物活性

PubChem BioAssay

化合物性质

理化性质

熔点

7°C

溶解度

54-56 ppm (at 20 °C) in water

soluble in glyceride oils, methanol, ethanol, ether, acetone, and most organic solvents, especially chlorinated hydrocarbons

沸点

87°C (at 0.01 mmHg)

外观

colorless, almost odorless liquid; 95-98% pure fenthion is a brown oily liquid with a weak garlic odor

密度

1.250 g/cm³ (at 20 °C / 4 °C)

蒸汽压

4 ? 10^-5 mmHg (at 20 °C)

闪点

>212 °F

>100 °C

产品相关信息

级别

PESTANAL®, analytical standard

analytical standard

Empirical Formula (Hill Notation)

C10H15O3PS2

包装

ampule of 250 mg

质检报告

下载链接

化合物信息

ID:127409