Biphenyl Diphenyl ether eutectic - eutectic mixture of 26.5% diphenyl + 73.5% diphenyl oxide , CAS No.8004-13-5

CAS: 8004-13-5 Cat. No.: D304674 EC Number: 616-827-0

GRADE & PURITY eutectic mixture of 26.5% diphenyl + 73.5% diphenyl oxide

Synonyms

Dowtherm(R)A | DTXSID9073387 | MFCD00148859 | PhPh PhOPh | diphenyl ether biphenyl | MHCVCKDNQYMGEX-UHFFFAOYSA-N | Dowtherm(R) A | DOWTHERM A | HSDB 137 | Dinyl | Dow-Therm-A | Dowtherm-A | Phenyl Ether-biphenyl Eutectic(w/w=7/3) | Therminol VP | biphenyl

Storage

Room temperature,Desiccated

Shipped In

Normal

Specifications

Synonyms

Dowtherm(R)A | DTXSID9073387 | MFCD00148859 | PhPh PhOPh | diphenyl ether biphenyl | MHCVCKDNQYMGEX-UHFFFAOYSA-N | Dowtherm(R) A | DOWTHERM A | HSDB 137 | Dinyl | Dow-Therm-A | Dowtherm-A | Phenyl Ether-biphenyl Eutectic(w/w=7/3) | Therminol VP | biphenyl

Specifications & Purity

eutectic mixture of 26.5% diphenyl + 73.5% diphenyl oxide

Storage

Room temperature,Desiccated

Shipped In

Normal

Names and Identifiers

Pubchem Sid

528775391

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/528775391

Canonical Smiles

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

IUPAC Name

1,1'-biphenyl;phenoxybenzene

InChIKey

MHCVCKDNQYMGEX-UHFFFAOYSA-N

INCHI

1S/C12H10O.C12H10/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;1-3-7-11(8-4-1)12-9-5-2-6-10-12/h1-10H;1-10H

Isomeric SMILES

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

Reaxy-Rn

13213899

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=13213899&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Class: Benzene and substituted derivatives
• Subclass: Diphenylethers
• Intermediate Tree Nodes: Not available
• Direct Parent: Diphenylethers
• Alternative Parents: Biphenyls and derivatives Polyphenyl ethers Diarylethers Phenoxy compounds Phenol ethers Aromatic hydrocarbons Unsaturated hydrocarbons Hydrocarbon derivatives
• Molecular Framework: Not available
• Substituents: Diphenylether - Biphenyl - Polyphenyl ether - Diaryl ether - Phenoxy compound - Phenol ether - Aromatic hydrocarbon - Ether - Organic oxygen compound - Unsaturated hydrocarbon - Hydrocarbon derivative - Organooxygen compound - Hydrocarbon - 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: 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

Chemical and Physical Properties

• Sensitivity: heat/air/moisture sensitive
• Melt Point(°C): 12-14°C (Lit.)
• Molecular Weight: 324.400 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 324.151 Da
• Monoisotopic Mass: 324.151 Da
• Topological Polar Surface Area: 9.200 Ų
• Heavy Atom Count: 25
• Formal Charge: 0
• Complexity: 216.000
• 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: 2

XLogP3