Dalapon - analytical standard , CAS No.75-99-0

CAS: 75-99-0 Cat. No.: D114722 Peso molecular: 142.97 Beilstein Registry Number: 1750149 Número EC: 200-923-0

GRADE & PURITY Analytical standard

Synonyms

Propanoic acid, 2,2-dichloro- | DTXCID201575 | Radapon (Salt/Mix) | VO6PY8ZMRW | Dowpon proprop | BH dalapon | NCGC00248007-01 | Basinex | CCRIS 7752 | FT-0609219 | Kenapon | Basinex P | NSC56352 | NSC-56352 | C18600 | CAS-75-99-0 | Dalapon, certified ref

Storage

Room temperature

Shipped In

Normal

Descripción general

Dalapon is a small, water soluble, organochlorine selective herbicide and plant growth regulator used to control perennial grasses. It is mainly used on food crops, including sugarcane and sugar beets.

Specifications

Sinónimos

Propanoic acid, 2, 2-dichloro- | DTXCID201575 | Radapon (Salt/Mix) | VO6PY8ZMRW | Dowpon proprop | BH dalapon | NCGC00248007-01 | Basinex | CCRIS 7752 | FT-0609219 | Kenapon | Basinex P | NSC56352 | NSC-56352 | C18600 | CAS-75-99-0 | Dalapon, certified ref

Especificaciones y pureza

analytical standard

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Grado

Analytical standard

Nombres e identificadores

• Sonrisas canónicas: CC(C(=O)O)(Cl)Cl
• IUPAC Name: 2,2-dichloropropanoic acid
• InChIKey: NDUPDOJHUQKPAG-UHFFFAOYSA-N
• INCHI: 1S/C3H4Cl2O2/c1-3(4,5)2(6)7/h1H3,(H,6,7)
• Isómeros SMILES: CC(C(=O)O)(Cl)Cl
• WGK Alemania: 1
• Número ONU: 1760
• Grupo de embalaje: I
• Peso molecular: 142.97
• Beilstein: 1750149
• Reaxy-Rn: 1750149
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1750149&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Clase Carboxylic acids and derivatives
      • Subclass Alpha-halocarboxylic acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Clase: Carboxylic acids and derivatives
• Subclass: Alpha-halocarboxylic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Alpha-halocarboxylic acids
• Alternative Parents: Monocarboxylic acids and derivatives Carboxylic acids Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl chlorides
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Alpha-halocarboxylic acid - Monocarboxylic acid or derivatives - Carboxylic acid - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organochloride - Organohalogen compound - Carbonyl group - Alkyl halide - Alkyl chloride - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as alpha-halocarboxylic acids. These are carboxylic acids containing a halogen atom bonded to the alpha carbon atom.
• External Descriptors: Pesticides

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

Objetivos asociados (humanos)

MAOA Tclin Monoamine oxidase A (11911 Activities)

Discover Target: MAOA

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

Mecanismos de acción

Propiedades químicas y físicas

• Sensibilidad: moisture sensitive
• Índice de refracción: 1.4544
• Punto de ebullición (°C): 90-92°C
• Peso molecular: 142.970 g/mol
• XLogP3: 1.300
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 141.959 Da
• Monoisotopic Mass: 141.959 Da
• Topological Polar Surface Area: 37.300 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 88.900
• 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

Referencias

1. Kai Wu, Yunyou Zhou, Tao Li, Junyong Sun, Xiaoqing Xing, Qian Song.  (2012)  Cadmium Tellurium Quantum Dots in Sol-Gel-Derived Silica Spheres Coated with Calix[6]Arene as an Optical Probe for Dalapon.  ANALYTICAL LETTERS,      [PMID:] [10.1080/00032719.2012.703740]