Di(ethylene glycol) benzyl ether - ≥98%(GC) , CAS No.2050-25-1

CAS: 2050-25-1 Cat. No.: D154354 Peso molecular: 196.25 Beilstein Registry Number: 6(2)413 Número EC: 887-830-4

GRADE & PURITY ≥98%(GC)

Synonyms

NSC23567 | NSC-23567 | 1-Phenyl-1-cyclopropanecarboxylic acid, 97% | Z235342055 | Benzyl-PE2-OH | 2-(2-(Benzyloxy)ethoxy)ethanol | Ethanol, 2-[2-(phenylmethoxy)ethoxy]- | AKOS015912831 | Di(ethylene glycol)benzyl ether | 5-TERT-BUTOXYCARBONYLAMINO-BENZO[B

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

NSC23567 | NSC-23567 | 1-Phenyl-1-cyclopropanecarboxylic acid, 97% | Z235342055 | Benzyl-PE2-OH | 2-(2-(Benzyloxy)ethoxy)ethanol | Ethanol, 2-[2-(phenylmethoxy)ethoxy]- | AKOS015912831 | Di(ethylene glycol)benzyl ether | 5-TERT-BUTOXYCARBONYLAMINO-BENZO[B

Especificaciones y pureza

≥98%(GC)

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥98%(GC)

Nombres e identificadores

• Pubchem Sid: 504757980
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504757980
• Sonrisas canónicas: C1=CC=C(C=C1)COCCOCCO
• IUPAC Name: 2-(2-phenylmethoxyethoxy)ethanol
• InChIKey: LJVNVNLFZQFJHU-UHFFFAOYSA-N
• INCHI: 1S/C11H16O3/c12-6-7-13-8-9-14-10-11-4-2-1-3-5-11/h1-5,12H,6-10H2
• Isómeros SMILES: C1=CC=C(C=C1)COCCOCCO
• WGK Alemania: 3
• Peso molecular: 196.25
• Beilstein: 6(2)413
• Reaxy-Rn: 1951137
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1951137&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Benzene and substituted derivatives
      • Subclass Benzylethers

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Benzylethers
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzylethers
• Alternative Parents: Dialkyl ethers Primary alcohols Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Benzylether - Ether - Dialkyl ether - Organic oxygen compound - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Alcohol - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as benzylethers. These are aromatic ethers with the general formula ROCR' (R = alkyl, aryl; R'=benzene).
• 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

• Solubilidad: Soluble in water
• Índice de refracción: 1.5110-1.5150
• Punto de inflamación (°C): 158 °C
• Peso molecular: 196.240 g/mol
• XLogP3: 0.700
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 7
• Exact Mass: 196.11 Da
• Monoisotopic Mass: 196.11 Da
• Topological Polar Surface Area: 38.700 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 122.000
• 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