Prothiofos (HCID 36870)

名称と識別子

優先名称: Prothiofos
IUPAC: (2,4-dichlorophenoxy)-ethoxy-propylsulfanyl-sulfanylidene-lambda5-phosphane
現地名: ジチオりん酸O-(2,4-ジクロロフェニル)O-エチルS-プロピル
英語名: Prothiofos
分子式: C11H15Cl2O2PS2
分子量: 345.25

名称と別名

ProthiofosPROTHIOPHOSTokuthion34643-46-4DichlorpropaphosToyodanBAY-NTN 8629DTXSID8042349Phosphorodithioic acid, O-(2,4-dichlorophenyl) O-ethyl S-propyl estero-(2,4-Dichlorophenyl) o-ethyl S-propyl phosphorodithioateH5232196GPDTXCID6022349

名称をさらに表示

トクチオントヨドンプロチオホスジチオりん酸=O-(2,4-ジクロロフェニル)=O-エチル=S-プロピルジクロルプロパホスジチオりん酸O-(2,4-ジクロロフェニル)-O-エチル-S-プロピルジチオりん酸O-(2,4-ジクロロフェニル)O-エチルS-プロピルジチオりん酸O-エチルO-(2,4-ジクロロフェニル)S-プロピルＯ－（２，４－ジクロロフェニル）Ｏ－エチルＳ－プロピルホスホロジチオエートプロチオホス標準品Ｏ（２，４ジクロロフェニル）ＯエチルＳプロピルホスホロジチオエトジチオりん酸O-2,4-ジクロロフェニル-O-エチル-S-プロピル（プロチオホス）ジチオりん酸O-2,4-ジクロロフェニル-O-エチル-S-プロピル (別名プロチオホス)ジチオリン酸O-2，4-ジクロロフェニル-O-エチル-S-プロピルプロチオホス標準液CS_N-13577-100MG_プロチオホストクチオン STANDARDトクチオン Standard, 100 µg/mL in MeOHトクチオン, 1000 µg/mL in HexaneトヨダンTokutionntn-8629toyothionbayntn8629Tokuthhion

CHEBI:38873O-(2,4-dichlorophenyl) O-ethyl S-propyl phosphorodithionateTukuthion(RS)-(O-2,4-DICHLOROPHENYL O-ETHYL S-PROPYL PHOSPHORODITHIOATE)RefChem:176651252-125-7685-654-0Bideron

データベース識別子

CAS: 34643-46-4
PubChem CID: 36870
DTXSID: DTXSID8042349
ChEMBL: CHEMBL1560680
ChEBI: CHEBI:38873
UNII: H5232196GP
EC Number: 252-125-7、685-654-0
Nikkaji: J3.495I

物性

構造計算による物性

XLogP: 4.9
極性表面積: 75.9 Å²
水素結合供与体数: 0
水素結合受容体数: 4
回転可能結合数: 7
重原子数: 18
形式電荷: 0
複雑度: 294

実験および物理化学的性質

Kovats Retention Index · 3 件

2093；2095；2129；2157；2157.2；2133.2；2101；2133.7；2125.7；2105；2120

2170；2153.3；2155.1；2160.8；2151.7；2150.6

2915

物理化学的性質

融点: 25 °C · 25°C
沸点: 126.5 °C · 126.5 °C
比重(密度): 1.3 · 1.3000
蒸気圧: 3 · 3.0×10-4 Pa (20 °C)
貯蔵温度: 4 °C · APPROX 4°C
水溶解度: 0.07 mg · 0.07 mg l-1 (20 °C)
外見: 液体
BRN: 1998314 · 1998314
Henry's Law Constant: 3.4 · 3.4×10-1 mol/(m3Pa) at 25℃, Ebert et al. (2023)
InChI: 1S/C11H15Cl2O2PS2/c1-3-7-18-16(17,14-4-2)15-11-6-5-9(12)8-10(11)13/h5-6,8H,3-4,7H2,1-2H3
InChIKey: FITIWKDOCAUBQD-UHFFFAOYSA-N
SMILES: CCCSP(=S)(OCC)Oc1ccc(Cl)cc1Cl
CAS データベース: 34643 · 34643-46-4(CAS DataBase Reference)
NISTの化学物質情報: Phosphorodithioic acid, o-(2,4-dichlorophenyl) o-ethyl s-propyl ester(34643-46-4)
EPAの化学物質情報: Prothiofos (34643-46-4)

安全と法規制

GHS分類

GHS Classification · 6 件

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H330 (92.9%): Fatal if inhaled [Danger Acute toxicity, inhalation]；H400 (92.9%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]；H410 (92.9%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]

P260, P264, P270, P271, P273, P284, P301+P317, P304+P340, P316, P320, P330, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 42 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Not Classified

危険有害性情報

Regulatory Information · 3 件

Hazard Traits - Environmental tox；Authoritative List - CWA 303(d)；Report - if used as a fragrance or flavor ingredient

2002/2076

Prothiofos: 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.

Other Safety InformationIMAP assessments - Phosphorodithioic acid, O-(2,4-dichlorophenyl) O-ethyl S-propyl ester: Human health tier I assessment；IMAP assessments - Phosphorodithioic acid, O-(2,4-dichlorophenyl) O-ethyl S-propyl ester: Environment tier I assessment

Hazard Classes and Categories · 2 件

Acute Tox. 4 (100%)；Acute Tox. 1 (92.9%)；Aquatic Acute 1 (92.9%)；Aquatic Chronic 1 (92.9%)

Acute toxicity (Oral) - Category 4；Acute toxicity (Dermal) - Category 5；Serious eye damage/eye irritation - Category 2B；Skin sensitization - Category 1；Specific target organ toxicity - Single exposure - Category 2 (nervous system)；Hazardous to the aquatic environment (Acute) - Category 1；Hazardous to the aquatic environment (Long-term) - Category 1

法規制情報

Regulatory Information · 3 件

Hazard Traits - Environmental tox；Authoritative List - CWA 303(d)；Report - if used as a fragrance or flavor ingredient

2002/2076

Prothiofos: 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.

安全データ

wgk: 3
rtecs: TD5680000
ridadr: UN 3082
PRTR法: 第1種指定化学物質
risk_code: 22-50/53
安衛法: 57,57-2
消防法: 危-4-1-S-II
hazard_code: Xn,N
safety_code: 60-61
毒劇物取締法: II
Hazard Classifications: Acute Tox. 1 InhalationAcute Tox. 4 OralAquatic Acute 1Aquatic Chronic 1
ストレージクラス: 6.1A - Combustible acute toxic Cat. 1 and 2very toxic hazardous materials

化学と産業

用途と製造

Use ClassificationPharmaceuticals

応用分野 · 2 件

説明Prothiofos is a colorless liquid. It is nearly insoluble in water (1.7 mg/L at 20 C) but readily soluble in most organic solvents. Log Kow = 5.67. It is relatively stable in aqueous media; DT50 values (22 C) at pH 4, 7, and 9 are 120, 280, and 12 d, respectively.

使用Prothiofos is used to control chewing insects in a range of crops including vegetables, fruit, maize, sugar cane and ornamentals.

上流・下流製品情報

上流原料

2,4-ジクロロフェノール炭酸カリウム 2-ブタノントリエチルアミン五硫化リン 1-ブロモプロパンチオりん酸O-(4-ブロモ-2-クロロフェニル)O-エチルS-プロピル

サプライヤー40 社

湖北万得化工有限公司15377098680 15377098680 · [email protected]

杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]

安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]

梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]

上海艾梯西生物科技有限公司18721763493

補足説明

定義ChEBI: An organic thiophosphate that is the 2,4-dichlorophenyl ester of O-ethyl S-propyl dithiophosphoric acid.

ジチオりん酸O-(2,4-ジクロロフェニル)O-エチルS-プロピル

基本情報