2,4-Dichlorophenol - analytical standard , CAS No.120-83-2

CAS: 120-83-2 Cat. No.: D117194 Fórmula: C₆H₄Cl₂O Peso molecular: 163 Beilstein Registry Number: 742467 Número EC: 204-429-6

CALIDAD & PUREZA Analytical standard

Synonyms

2,4-D TP1|Phenol, 2,4-dichloro-|2,4-DICHLOROPHENOL [MI]|2,4-dichloro phenol|Phen-3,5-d2-ol-d, 2,4-dichloro- (9CI)|2,4-DICHLOROPHENOL [USP-RS]|2,4-DICHLOROPHENOL [HSDB]|1,3-Dichloro-4-hydroxybenzene|4,6-Dichlorophenol|2,4-Dichlorohydroxybenzene|2,4-DCP|24-DICHLOROPHENOL|2,4-Dichlorophenic acid|2,4-Dichlorophenol;4,6-Dichlorophenol|RCRA waste no. U081|2,4-DICHLOROPHENOL|2,4-dichloro-Phenol|2,4-Dichlorophenate|1-Hydroxy-2,4-dichlorobenzene|2,4,-dichlorophenol

Storage

Protected from light,Room temperature

Shipped In

FedEx DG Service

Especificaciones

Sinónimos

2,4-D TP1 | Phenol, 2,4-dichloro- | 2,4-DICHLOROPHENOL [MI] | 2,4-dichloro phenol | Phen-3,5-d2-ol-d, 2,4-dichloro- (9CI) | 2,4-DICHLOROPHENOL [USP-RS] | 2,4-DICHLOROPHENOL [HSDB] | 1,3-Dichloro-4-hydroxybenzene | 4,6-Dichlorophenol | 2,4-Dichlorohydroxybenzene | 2,4-DCP | 24-DICHLOROPHENOL | 2,4-Dichlorophenic acid | 2,4-Dichlorophenol;4 Show more

Especificaciones y pureza

analytical standard

Condiciones de almacenamiento de almacenamiento

Protected from light,Room temperature

Enviado en

FedEx DG Service

Grado

Patrón analítico

Nombres e identificadores

Pubchem Sid

504751680

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504751680

Sonrisas canónicas

C1=CC(=C(C=C1Cl)Cl)O

IUPAC Name

2,4-dichlorophenol

InChIKey

HFZWRUODUSTPEG-UHFFFAOYSA-N

INCHI

1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H

Isómeros SMILES

C1=CC(=C(C=C1Cl)Cl)O

WGK Alemania

3

Número ONU

2020

Grupo de embalaje

III

Peso molecular

163

Beilstein

742467

Reaxy-Rn

742467

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=742467&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Benzene and substituted derivatives
      • Subclass Halobenzenes
        • Level5 Chlorobenzenes
          • Level6 Dichlorobenzenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Halobenzenes
• Intermediate Tree Nodes: Chlorobenzenes
• Direct Parent: Dichlorobenzenes
• Alternative Parents: P-chlorophenols O-chlorophenols 1-hydroxy-2-unsubstituted benzenoids Aryl chlorides Organooxygen compounds Organochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: 4-chlorophenol - 2-chlorophenol - 2-halophenol - 4-halophenol - 1,3-dichlorobenzene - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Aryl halide - Aryl chloride - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organochloride - Organohalogen compound - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as dichlorobenzenes. These are compounds containing a benzene with exactly two chlorine atoms attached to it.
• External Descriptors: a chloroaromatic compound

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)

TSHR Tclin Thyroid stimulating hormone receptor (29986 Activities)

Discover Target: TSHR

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Lymphoblastoid cell (5959 Activities)

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HSD17B10 Tchem Endoplasmic reticulum-associated amyloid beta-peptide-binding protein (20669 Activities)

Discover Target: HSD17B10

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Objetivos asociados (no humanos)

Bacillus subtilis (32866 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

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Mecanismos de acción

Propiedades químicas y físicas

• Solubilidad: Soluble in ethanol, ether, benzene and carbon tetrachloride, slightly soluble in water.
• Sensibilidad: Light sensitive.
• Punto de inflamación (°F): 231.1 °F - closed cup
• Punto de inflamación (°C): 110.6 °C - closed cup
• Punto de ebullición (°C): 210°C
• Punto de fusión (°C): 43 °C
• Peso molecular: 163.000 g/mol
• XLogP3: 3.100
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 161.964 Da
• Monoisotopic Mass: 161.964 Da
• Topological Polar Surface Area: 20.200 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 97.100
• 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