Diethylene glycol monomethyl ether - ≥98%, contains 50-150 ppm BHTas stabilizer , CAS No.111-77-3

CAS: 111-77-3 Cat. No.: D104408 Peso molecular: 120.15 Beilstein Registry Number: 1697812 Número EC: 203-906-6

GRADE & PURITY ≥98%, contains 50-150 ppm BHTas stabilizer

Synonyms

.beta.-Methoxy-.beta.'-hydroxydiethyl ether | m-PEG-OH, MW 2,000 | W-109062 | BP-23184 | BP-13446 | Hicotol CAR | Methyl karbitol [Czech] | mPEG2-OH | Ethanol, 2-(2-methoxyethoxy)- | methylcarbitol | Methyldiglycol | m-PEG-OH, MW 5,000 | 2-(2-Methoxyethox

Storage

Desiccated,Room temperature

Shipped In

Normal

Specifications

Sinónimos

.beta.-Methoxy-.beta.'-hydroxydiethyl ether | m-PEG-OH, MW 2, 000 | W-109062 | BP-23184 | BP-13446 | Hicotol CAR | Methyl karbitol [Czech] | mPEG2-OH | Ethanol, 2-(2-methoxyethoxy)- | methylcarbitol | Methyldiglycol | m-PEG-OH, MW 5, 000 | 2-(2-Methoxyethox

Especificaciones y pureza

≥98%, contains 50-150 ppm BHTas stabilizer

Condiciones de almacenamiento de almacenamiento

Desiccated, Room temperature

Enviado en

Normal

Pureza

≥98%

Nombres e identificadores

• Pubchem Sid: 504751597
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504751597
• Sonrisas canónicas: COCCOCCO
• IUPAC Name: 2-(2-methoxyethoxy)ethanol
• InChIKey: SBASXUCJHJRPEV-UHFFFAOYSA-N
• INCHI: 1S/C5H12O3/c1-7-4-5-8-3-2-6/h6H,2-5H2,1H3
• Isómeros SMILES: COCCOCCO
• WGK Alemania: 3
• RTECS: KL6125000
• Número ONU: 2810
• Grupo de embalaje: I
• Peso molecular: 120.15
• Beilstein: 1697812
• Reaxy-Rn: 1697812
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1697812&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Clase Organooxygen compounds
      • Subclass Ethers

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Clase: Organooxygen compounds
• Subclass: Ethers
• Intermediate Tree Nodes: Not available
• Direct Parent: Dialkyl ethers
• Alternative Parents: Primary alcohols Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Dialkyl ether - Hydrocarbon derivative - Primary alcohol - Alcohol - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as dialkyl ethers. These are organic compounds containing the dialkyl ether functional group, with the formula ROR', where R and R' are alkyl groups.
• External Descriptors: diether - hydroxypolyether

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)

NR3C1 Tclin Glucocorticoid receptor (14987 Activities)

Discover Target: NR3C1

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

Mecanismos de acción

Propiedades químicas y físicas

• Solubilidad: Soluble in water, chloroform, ethanol, and ether, miscible in alcohols, ketones, and hydrocarbons.
• Sensibilidad: Hygroscopic
• Índice de refracción: 1.425-1.427
• Punto de inflamación (°F): 181.4℉
• Punto de inflamación (°C): 83℃
• Punto de ebullición (°C): 194°C
• Punto de fusión (°C): -70°C
• Peso molecular: 120.150 g/mol
• XLogP3: -0.900
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 120.079 Da
• Monoisotopic Mass: 120.079 Da
• Topological Polar Surface Area: 38.700 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 38.700
• 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

Referencias

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