Quinalphos - analytical standard, ≥99.5% , CAS No.13593-03-8

CAS: 13593-03-8 Cat. No.: Q109846 Formula: C₁₂H₁₅N₂O₃PS Molecular Weight: 298.3 Beilstein Registry Number: 754823 EC Number: 237-031-6 PubChem CID: 26124

GRADE & PURITY Analytical standard, ≥99.5%

Synonyms

O,O-Diaethyl-O-(chinoxalyl-(2))-monothiophosphat [German]|Savall|Ekalux|O,O-Diethyl-O-(2-quinoxalinyl) phosphorothioate|SAN-6538|O,O-Diethyl O-2-quinoxalinyl phosphorothioic acid ester|Quinaltaf|Sandoz 6538|Diethyl O-(2-quinoxalyl) phosphorothioate|QUINALPHOS [ISO]|O,O-diethyl O-quinoxalin-2-yl thiophosphate|BAY-77049|diethoxy-quinoxalin-2-yloxy-sulfanylidenephosphorane|Ekalux 25EC|o,o-Diethyl O-2-quinoxalinyl phosphorothioate|Diethquinalphion|O,O-Diethyl O-quinoxalin-2-yl phosphorothioate|Chinalphos|Diethyl O-2-quinoxalinyl phosphorothioate|Guinalphos|QUINALPHOS|Diethyl 2-Quinoxalyl phosphorothionate|Diethyl O-quinoxalin-2-yl thionophosphate|SAN 6538 I|Wie oben|Quinalphos [BSI:ISO]|SRA 7312|BAY 5821|O,O-Diethyl O-(2-quinoxalyl) phosphorothionate|O,O-Diethyl O-(quinoxalin-2-yl) thiophosphate|O,O-Diethyl-O-2-quinoxalyl-thiophosphate|Phosphorothioic acid, O,O-diethyl O-2-quinoxalinyl ester|O,O-Diaethyl-O-(chinoxalyl-(2))-monothiophosphat|O,O-Diethyl-O-(quinoxalinyl-(2))-thionophosphate|O,O-Diethyl O-(2-quinoxalinyl) thiophosphate #|Quinalphos 25 EC|Phosphorothioic acid, O,O-diethyl O-(2-quinoxalinyl) ester|Quinolphos|diethoxy-quinoxalin-2-yloxy-sulfanylidene-$l^{5}-phosphane|SAN 6538|Sandoz 6626|QUINALFOS|Diethyl O-(quinoxalin-2-yl) thiophosphate|OLEOEKALUX|O,O-DIETHYL-O-QUINOXAL-2-YL THIONOPHOSPHATE|Diethchinalphion|O,O-Diethyl-O-(2-quinoxalyl) phosphorothioate|BAY 77049|diethoxy-quinoxalin-2-yloxy-sulfanylidene-lambda5-phosphane|O,O-Diethyl O-(2-chinoxalyl)-phosphorothioate|Spencer S-6538|Bayrusil|o,o-diethyl o-(2-quinoxalyl)phosphorothionate|O,O-diethyl O-(quinoxalin-2-yl) phosphorothioate

Storage

Protected from light,Room temperature,Desiccated

Shipped In

FedEx DG Service

Specifications

Synonyms

O,O-Diaethyl-O-(chinoxalyl-(2))-monothiophosphat [German] | Savall | Ekalux | O,O-Diethyl-O-(2-quinoxalinyl) phosphorothioate | SAN-6538 | O,O-Diethyl O-2-quinoxalinyl phosphorothioic acid ester | Quinaltaf | Sandoz 6538 | Diethyl O-(2-quinoxalyl) phosphorothioate | QUINALPHOS [ISO] | O,O-diethyl O-quinoxalin-2-yl thiophosphate | BAY-7704 Show more

Specifications & Purity

analytical standard, ≥99.5%

Storage

Protected from light,Room temperature,Desiccated

Shipped In

FedEx DG Service

Grade

Analytical standard

Purity

≥99.5%

Product Line

Q109846-20mg

Names and Identifiers

Pubchem Sid

508812979

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/508812979

Canonical Smiles

CCOP(=S)(OCC)OC1=NC2=CC=CC=C2N=C1

IUPAC Name

diethoxy-quinoxalin-2-yloxy-sulfanylidene-λ5-phosphane

InChIKey

JYQUHIFYBATCCY-UHFFFAOYSA-N

INCHI

1S/C12H15N2O3PS/c1-3-15-18(19,16-4-2)17-12-9-13-10-7-5-6-8-11(10)14-12/h5-9H,3-4H2,1-2H3

Isomeric SMILES

CCOP(=S)(OCC)OC1=NC2=CC=CC=C2N=C1

WGK Germany

3

RTECS

TF6125000

PubChem CID

26124

UN Number

2810

Molecular Weight

298.3

Beilstein

754823

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Class Diazanaphthalenes
      • Subclass Benzodiazines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Diazanaphthalenes
• Subclass: Benzodiazines
• Intermediate Tree Nodes: Not available
• Direct Parent: Quinoxalines
• Alternative Parents: Aryl thiophosphates Thiophosphate triesters Pyrazines Benzenoids Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Quinoxaline - Aryl thiophosphate - Thiophosphate triester - Thiophosphoric acid ester - Pyrazine - Organic thiophosphoric acid or derivatives - Benzenoid - Heteroaromatic compound - Azacycle - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Aromatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as quinoxalines. These are compounds containing a quinoxaline moiety, a bicyclic heterocycle made up of a benzene ring fused to a pyrazine ring.
• 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

Associated Targets(Human)

RXRA Tclin Retinoid X receptor alpha (3637 Activities)

Discover Target: RXRA

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

AHR Tclin Aryl hydrocarbon receptor (1071 Activities)

Discover Target: AHR

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

Associated Targets(non-human)

Oryza sativa (2923 Activities)

Explore this target

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

Nfe2l2 Nuclear factor erythroid 2-related factor 2 (214 Activities)

Discover Target: Nfe2l2

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

Lepidoptera (26 Activities)

Explore this target

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

Mechanisms of Action

Chemical and Physical Properties

• Sensitivity: Light sensitive.
• x_refractive_index: 1.5642
• x_flash_point_drop_fahrenheit: 100℃
• x_flash_point_drop_centigrade: 100℃
• x_boil_point_char: 142°C
• x_melt_point_char: 31-32°C
• Molecular Weight: 298.300 g/mol
• XLogP3: 4.400
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 6
• Exact Mass: 298.054 Da
• Monoisotopic Mass: 298.054 Da
• Topological Polar Surface Area: 85.600 Ų
• Heavy Atom Count: 19
• Formal Charge: 0
• Complexity: 322.000
• 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

Frequently Asked Questions

What is the purity of this product?

This product is supplied at ≥99.5% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

What does analytical standard mean?

analytical standard is a defined analytical purity tier suitable for quantitative analytical methods. It specifies a minimum assay percentage, controlled limits on common impurities (water, heavy metals, residue on ignition), and lot-to-lot consistency. analytical standard is one of several purity tiers — choose based on the sensitivity and regulatory requirements of your method.

How should this product be stored?

Store at room temperature, protected from light, desiccated. Keep the container tightly closed with desiccant — the material is moisture-sensitive.

How is this product shipped?

This product is classified as dangerous goods and ships via FedEx DG Service. Ground and other economy services are not available, and delivery to some destinations or address types may be restricted.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 13593-03-8, the molecular formula is C12H15N2O3PS, and the molecular weight is 298.3 g/mol. InChIKey JYQUHIFYBATCCY-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.