Diphenyl ether - ≥98% , CAS No.101-84-8

CAS: 101-84-8 Cat. No.: D110645 Formule: C₁₂H₁₀O Poids moléculaire: 170.21 Beilstein Registry Number: 1364620 Numéro CE: 202-981-2

QUALITÉ & PURETÉ ≥98%

Synonyms

1,1'-Oxybisbenzene, 9CI | 1-Phenoxybenzene | AI3-00749 | CCRIS 5912 | Diphenylaether | EINECS 202-981-2 | HSDB 934 | Ph2O | Diphenyl oxide | NCGC00091303-01 | NSC 19311 | Diphenyl ether, Selectophore(TM), >=99.9% | Oxydibenzene | PROPOFOL IMPURITY I [EP I

Storage

Desiccated,Room temperature

Shipped In

Normal

Spécifications

Synonymes

1,1'-Oxybisbenzene, 9CI | 1-Phenoxybenzene | AI3-00749 | CCRIS 5912 | Diphenylaether | EINECS 202-981-2 | HSDB 934 | Ph2O | Diphenyl oxide | NCGC00091303-01 | NSC 19311 | Diphenyl ether, Selectophore(TM), >=99.9% | Oxydibenzene | PROPOFOL IMPURITY I [EP I

Spécifications et pureté

≥98%

Conditions de stockage de stockage

Desiccated,Room temperature

Expédié en

Normal

Pureté

≥98%

Noms et identifiants

Pubchem Sid

528769779

Sourires canoniques

C1=CC=C(C=C1)OC2=CC=CC=C2

IUPAC Name

phenoxybenzene

InChIKey

USIUVYZYUHIAEV-UHFFFAOYSA-N

INCHI

1S/C12H10O/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h1-10H

Isomères SMILES

C1=CC=C(C=C1)OC2=CC=CC=C2

WGK Allemagne

2

RTECS

KN8970000

Numéro ONU

3077(international)

Groupe d'emballage

III

Poids moléculaire

170.21

Beilstein

1364620

Reaxy-Rn

1364620

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1364620&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Benzene and substituted derivatives
      • Subclass Diphenylethers

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Diphenylethers
• Intermediate Tree Nodes: Not available
• Direct Parent: Diphenylethers
• Alternative Parents: Polyphenyl ethers Diarylethers Phenoxy compounds Phenol ethers Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Diphenylether - Polyphenyl ether - Diaryl ether - Phenoxy compound - Phenol ether - Ether - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as diphenylethers. These are aromatic compounds containing two benzene rings linked to each other through an ether group.
• External Descriptors: aromatic ether

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

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Mécanismes d'action

Propriétés chimiques et physiques

• Solubilité: Not soluble in water, but miscible with most organic solvents such as alcohols and ethers.
• Point de congélation (°C): 27 °C
• Indice de réfraction: 1.579
• Point d'éclair (°F): 239℉
• Point d'éclair (°C): 115℃
• Point d'ébullition (°C): 258°C
• Point de fusion (°C): 27°C
• Poids moléculaire: 170.210 g/mol
• XLogP3: 4.200
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 170.073 Da
• Monoisotopic Mass: 170.073 Da
• Topological Polar Surface Area: 9.200 Ų
• Heavy Atom Count: 13
• Formal Charge: 0
• Complexity: 116.000
• 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