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Cadusafos - analytical standard，95%, high purity , CAS No.95465-99-9
Basic Description
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(
Specifications & Purity
analytical standard, ≥95%
Storage Temp
Protected from light
Shipped In
Normal
Grade
analytical standard
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organophosphorus compounds
Class
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
Description
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.
Associated Targets(non-human)
Mechanisms of Action
Mechanism of Action
Action Type
target ID
Target Name
Target Type
Target Organism
Binding Site Name
References
Names and Identifiers
IUPAC Name
2-[butan-2-ylsulfanyl(ethoxy)phosphoryl]sulfanylbutane
INCHI
InChI=1S/C10H23O2PS2/c1-6-9(4)14-13(11,12-8-3)15-10(5)7-2/h9-10H,6-8H2,1-5H3
InChIKey
KXRPCFINVWWFHQ-UHFFFAOYSA-N
Smiles
CCC(C)SP(=O)(OCC)SC(C)CC
Isomeric SMILES
CCC(C)SP(=O)(OCC)SC(C)CC
WGK Germany
3
Molecular Weight
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=
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Sensitivity
Light sensitive.
Flash Point(°C)
129°C
Molecular Weight
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
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K1901139