Diphenyl ether - ≥99.9%(GC) , CAS No.101-84-8

CAS: 101-84-8 Cat. No.: D130016 Formule: C₁₂H₁₀O Poids moléculaire: 170.21 Beilstein Registry Number: 1364620 Numéro CE: 202-981-2

GRADE & PURITY ≥99.9%(GC)

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

Room temperature

Shipped In

Normal

Vue d’ensemble

Used as plasticizing solvent mediator for PVC-based membranes.

Specifications

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

≥99.9%(GC)

Conditions de stockage de stockage

Room temperature

Expédié en

Normal

Pureté

≥99.9%(GC)

Noms et identifiants

Pubchem Sid

488180494

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488180494

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

Cibles associées (humaines)

TSHR Tclin Thyroid stimulating hormone receptor (29986 Activities)

Discover Target: TSHR

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

LTA4H Tchem Leukotriene A4 hydrolase (1442 Activities)

Discover Target: LTA4H

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

NR1H4 Tclin Bile acid receptor FXR (6228 Activities)

Discover Target: NR1H4

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

HepG2 (196354 Activities)

Explore this target

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

Lymphoblastoid cell (5959 Activities)

Explore this target

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

APEX1 Tchem DNA-(apurinic or apyrimidinic site) lyase (38016 Activities)

Discover Target: APEX1

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

Mécanismes d'action

Propriétés chimiques et physiques

• 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

Foire aux questions

What is the purity of this product, and how is it determined?

This product is supplied at ≥99.9% purity, determined by gas chromatography (GC). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 101-84-8, the molecular formula is C12H10O, and the molecular weight is 170.21 g/mol. InChIKey USIUVYZYUHIAEV-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.