エディフェンホス - 分析標準 , CAS No.17109-49-8

CAS: 17109-49-8 Cat. No.: E114222 分子式: C₁₄H₁₅O₂PS₂ 分子量: 310.37 Beilstein Registry Number: 1988797 EC番号: 241-178-1

グレード＆純度 Analytical standard

Synonyms

Ediphenphos|EDIFENPHOS [HSDB]|Bay-hinosan|Edifenphos [ISO]|[ethoxy(phenylsulfanyl)phosphoryl]sulfanylbenzene|O-Ethyl S,S-diphenyl dithiophosphate|O-Ethyl-S,S-diphenyl dithiophosphate|Edifenfos|BAY 78418|Phosphorodithioic acid, O-ethyl-S,S-diphenyl ester|Edifenphos (EDDP)|Edifenphos [BSI:ISO]|O-Aethyl-S,S-diphenyl-dithiophosphat|Blastoff|Phosphorodithioic acid, O-ethyl S,S-diphenyl ester|EDDP (pesticide)|O-ETHYL S,S-DIPHENYL PHOSPHORODITHIOATE|Ediphenophos|SRA 7847|Edifenphos|O-Aethyl-S,S-diphenyl-dithiophosphat [German]|Dithiophosphorsaeure-O-aethyl-S,S-diphenylester [German]|EDDP|O-Ethyl-S,S-diphenyl phosphorodithioate|Hinosan|Dithiophosphorsaeure-O-aethyl-S,S-diphenylester|Edifenphos, BSI|(ethoxy-phenylsulfanylphosphoryl)sulfanylbenzene|ethyl bis(phenylsulfanyl)phosphinate|Phosphorodithioic acid O-ethyl S,S-diphenyl ester

Storage

Protected from light,Room temperature

Shipped In

ノーマル

仕様

同義語

Ediphenphos | EDIFENPHOS [HSDB] | Bay-hinosan | Edifenphos [ISO] | [ethoxy(phenylsulfanyl)phosphoryl]sulfanylbenzene | O-Ethyl S,S-diphenyl dithiophosphate | O-Ethyl-S,S-diphenyl dithiophosphate | Edifenfos | BAY 78418 | Phosphorodithioic acid, O-ethyl-S,S-diphenyl ester | Edifenphos (EDDP) | Edifenphos [BSI:ISO] | O-Aethyl-S,S-diphenyl-d もっと見る

仕様と純度

分析標準

保管条件

Protected from light,Room temperature

入荷

ノーマル

等級

分析用標準物質

名前と識別子

パブケム・シド

528771943

カノニカル・スマイル

CCOP(=O)(SC1=CC=CC=C1)SC2=CC=CC=C2

IUPAC Name

[ethoxy(phenylsulfanyl)phosphoryl]sulfanylbenzene

InChIKey

AWZOLILCOUMRDG-UHFFFAOYSA-N

INCHI

1S/C14H15O2PS2/c1-2-16-17(15,18-13-9-5-3-6-10-13)19-14-11-7-4-8-12-14/h3-12H,2H2,1H3

異性体SMILES

CCOP(=O)(SC1=CC=CC=C1)SC2=CC=CC=C2

WGKドイツ

3

RTECS

TE3850000

UN番号

2810

分子量

310.37

Beilstein

1988797

Reaxy-Rn

1988797

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1988797&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • 分類 Benzene and substituted derivatives

• Kingdom: Organic compounds
• Superclass: Benzenoids
• 分類: Benzene and substituted derivatives
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzene and substituted derivatives
• Alternative Parents: Sulfenyl compounds Organothiophosphorus compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Monocyclic benzene moiety - Sulfenyl compound - Organothiophosphorus compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Aromatic homomonocyclic compound
• 説明: This compound belongs to the class of organic compounds known as benzene and substituted derivatives. These are aromatic compounds containing one monocyclic ring system consisting of benzene.
• External Descriptors: Organophosphorus fungicides

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

関連ターゲット（人間）

KCNH2 Tclin HERG (29587 Activities)

Discover Target: KCNH2

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

関連ターゲット（非人間）

Pyricularia grisea (1253 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

作用メカニズム

化学的性質と物理的性質

• 感度: Light sensitive.
• 屈折率: 1.61
• 沸点（°C）: 154°C
• 分子量: 310.400 g/mol
• XLogP3: 3.800
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 310.025 Da
• Monoisotopic Mass: 310.025 Da
• Topological Polar Surface Area: 76.900 Ų
• Heavy Atom Count: 19
• Formal Charge: 0
• Complexity: 276.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1