O,O-Dimetil fosforamidotioato - ≥90% , CAS No.17321-47-0

CAS: 17321-47-0 Cat. No.: O305174 Peso molecular: 141.13

GRADE & PURITY ≥90%

Synonyms

Amidate (pesticide) | E-118 amide | A811496 | AKOS006271579 | DMPAT | FT-0655504 | O,O-dimethylamidothiophosphate | NSC133028 | NSC-133028 | O,O-dimethyl ester | Tox21_303881 | MFCD00127995 | o,o-Dimethyl amidothiophosphate | O,O-Dimethyl thiophosphoramid

Storage

Conservar a 2-8°C

Shipped In

Hielo húmedo

Specifications

Sinónimos

Amidate (pesticide) | E-118 amide | A811496 | AKOS006271579 | DMPAT | FT-0655504 | O, O-dimethylamidothiophosphate | NSC133028 | NSC-133028 | O, O-dimethyl ester | Tox21_303881 | MFCD00127995 | o, o-Dimethyl amidothiophosphate | O, O-Dimethyl thiophosphoramid

Especificaciones y pureza

≥90%

Condiciones de almacenamiento de almacenamiento

Conservar a 2-8°C

Enviado en

Hielo húmedo

Pureza

≥90%

Nombres e identificadores

• Sonrisas canónicas: COP(=S)(N)OC
• IUPAC Name: [amino(methoxy)phosphinothioyl]oxymethane
• InChIKey: NKYPKIVMIGIWOB-UHFFFAOYSA-N
• INCHI: 1S/C2H8NO2PS/c1-4-6(3,7)5-2/h1-2H3,(H2,3,7)
• Isómeros SMILES: COP(=S)(N)OC
• Peso molecular: 141.13
• Reaxy-Rn: 1702246
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1702246&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Clase Organic thiophosphoric acids and derivatives
      • Subclass Thiophosphoric acid esters

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Clase: Organic thiophosphoric acids and derivatives
• Subclass: Thiophosphoric acid esters
• Intermediate Tree Nodes: Not available
• Direct Parent: Thiophosphoric acid esters
• Alternative Parents: Organooxygen compounds Organic nitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Thiophosphoric acid ester - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as thiophosphoric acid esters. These are organic compounds containing the thiophosphoric acid functional group or a derivative thereof, with the general structure ROP(OR')(OR'')=S, where at least one R-group is an organyl group.
• External Descriptors: Not available

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

Propiedades químicas y físicas

• Peso molecular: 141.130 g/mol
• XLogP3: 0.500
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 141.001 Da
• Monoisotopic Mass: 141.001 Da
• Topological Polar Surface Area: 76.600 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 87.700
• 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