Cadusafos - analytical standard, ≥95% , CAS No.95465-99-9

CAS: 95465-99-9 Cat. No.: C117645 分子式: C₁₀H₂₃O₂PS₂ 分子量: 270.39 Beilstein Registry Number: 8140049 EC番号: 619-129-4

GRADE & PURITY Analytical standard, ≥95%

Synonyms

Cadusafos|95465-99-9|Ebufos|Sebufos|Sebuphos|Rugby|Taredan|S,S-Di-sec-butyl O-ethyl phosphorodithioate|Cadusafos [ISO]|O-Ethyl-S,S-di-sec-butylphosphorodithioate|FMC 67825|103735-82-6|2-[butan-2-ylsulfanyl(ethoxy)phosphoryl]sulfanylbutane|O-Ethyl-S,S-bis(

Storage

Protected from light,Room temperature

Shipped In

Normal

Specifications

同義語

Cadusafos | 95465-99-9 | Ebufos | Sebufos | Sebuphos | Rugby | Taredan | S,S-Di-sec-butyl O-ethyl phosphorodithioate | Cadusafos [ISO] | O-Ethyl-S,S-di-sec-butylphosphorodithioate | FMC 67825 | 103735-82-6 | 2-[butan-2-ylsulfanyl(ethoxy)phosphoryl]sulfanylbutane | O-Ethyl-S,S-bis(

仕様と純度

analytical standard, ≥95%

保管条件

Protected from light,Room temperature

入荷

Normal

等級

分析用標準物質

純度

≥95%

名前と識別子

• パブケム・シド: 528774066
• カノニカル・スマイル: CCC(C)SP(=O)(OCC)SC(C)CC
• IUPAC Name: 2-[butan-2-ylsulfanyl(ethoxy)phosphoryl]sulfanylbutane
• InChIKey: KXRPCFINVWWFHQ-UHFFFAOYSA-N
• INCHI: 1S/C10H23O2PS2/c1-6-9(4)14-13(11,12-8-3)15-10(5)7-2/h9-10H,6-8H2,1-5H3
• 異性体SMILES: CCC(C)SP(=O)(OCC)SC(C)CC
• WGKドイツ: 3
• 分子量: 270.39
• Beilstein: 8140049
• Reaxy-Rn: 8140049
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=8140049&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organophosphorus compounds
    • 分類 Organothiophosphorus compounds

• Kingdom: Organic compounds
• Superclass: Organophosphorus compounds
• 分類: Organothiophosphorus compounds
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Organothiophosphorus compounds
• Alternative Parents: Sulfenyl compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Sulfenyl compound - Organothiophosphorus compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Aliphatic acyclic compound
• 説明: This compound belongs to the class of organic compounds known as organothiophosphorus compounds. These are organic derivatives of thiophosphonic acid, thiophosphoric acid, dithiophosphoric acid, or phosphorotrithioic acid, or derivatives thereof. Thiophosphonic acid, dithiophosphoric acid, thiophosphoric acid, and phosphorotrithioic acid are thiophosphorus compounds with the formula OP(O)(=S), OP(S)(=S)O, OP(O)(=S)O, and OP(=S)(S)S, respectively.
• External Descriptors: Organophosphorus insecticides

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

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作用メカニズム

化学的性質と物理的性質

• 感度: Light sensitive.
• 引火点（°C）: 129°C
• 分子量: 270.400 g/mol
• XLogP3: 3.300
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 8
• Exact Mass: 270.088 Da
• Monoisotopic Mass: 270.088 Da
• Topological Polar Surface Area: 76.900 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 196.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 2
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1