Edifenphos - analytical standard , CAS No.17109-49-8

CAS: 17109-49-8 Cat. No.: E114222 Fórmula: C₁₄H₁₅O₂PS₂ Peso molecular: 310.37 Beilstein Registry Number: 1988797 Número CE: 241-178-1

GRADE & PURITY Analytical standard

Synonyms

BDBM50417962 | Ediphenphos | EDIFENPHOS [HSDB] | CHEBI:34735 | DTXSID7041910 | Bay-hinosan | Edifenphos [ISO] | [ethoxy(phenylsulfanyl)phosphoryl]sulfanylbenzene | O-Ethyl S,S-diphenyl dithiophosphate | O-Ethyl-S,S-diphenyl dithiophosphate | Edifenfos | B

Storage

Protected from light,Room temperature

Shipped In

FedEx DG Service

Specifications

Sinónimos

BDBM50417962 | Ediphenphos | EDIFENPHOS [HSDB] | CHEBI:34735 | DTXSID7041910 | Bay-hinosan | Edifenphos [ISO] | [ethoxy(phenylsulfanyl)phosphoryl]sulfanylbenzene | O-Ethyl S,S-diphenyl dithiophosphate | O-Ethyl-S,S-diphenyl dithiophosphate | Edifenfos | B

Especificações e pureza

analytical standard

Condições de armazenamento de armazenamento

Protected from light,Room temperature

Enviado em

FedEx DG Service

Grau

Padrão analítico

Nomes e identificadores

• Pubchem Sid: 528771943
• Sorrisos canónicos: 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
• SMILES isoméricas: CCOP(=O)(SC1=CC=CC=C1)SC2=CC=CC=C2
• WGK Alemanha: 3
• RTECS: TE3850000
• Número UN: 2810
• Peso molecular: 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
    • Classe Benzene and substituted derivatives

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: 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
• Descrição: 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

Alvos associados (humanos)

KCNH2 Tclin HERG (29587 Activities)

Discover Target: KCNH2

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

Alvos associados (não humanos)

Pyricularia grisea (1253 Activities)

Explore this target

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

Mecanismos de ação

Propriedades químicas e físicas

• Sensibilidade: Light sensitive.
• Índice de refração: 1.61
• Ponto de ebulição (°C): 154°C
• Peso molecular: 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

Referências

1. Linfeng Chen, Xike Tian, Yong Li, Liqiang Lu, Yulun Nie, Yanxin Wang.  (2020)  Broad-spectrum pesticide screening by multiple cholinesterases and thiocholine sensors assembled high-throughput optical array system.  JOURNAL OF HAZARDOUS MATERIALS,      [PMID:33254811] [10.1016/j.jhazmat.2020.123830]

2. Wang Chengke, Wang Chengen, Wang Qingqing, Chen Dan.  (2017)  Resonance light scattering method for detecting kanamycin in milk with enhanced sensitivity.  ANALYTICAL AND BIOANALYTICAL CHEMISTRY,  409  (11): (2839-2846).  [PMID:28168547] [10.1007/s00216-017-0228-7]

3. Wang Chengke, Chen Dan, Wang Qingqing, Wang Qiuxia.  (2016)  Aptamer-based Resonance Light Scattering for Sensitive Detection of Acetamiprid.  ANALYTICAL SCIENCES,  32  (7): (757-762).  [PMID:27396657] [10.2116/analsci.32.757]

4. Kun Xu, Rui Xu, Xuejing Liu, Qin Wei.  (2025)  A self-powered photoelectrochemical sensor based on Cs3Bi2Br9/BiOBr photocathode for acetamiprid detection in vegetables.  FOOD CHEMISTRY,      [PMID:40286723] [10.1016/j.foodchem.2025.144460]