1,2-Difluorobenzene - ≥98%(GC) , CAS No.367-11-3

CAS: 367-11-3 Cat. No.: D155287 Formule: C₆H₄F₂ Poids moléculaire: 114.09 Numéro CE: 206-680-7

GRADE & PURITY ≥98%(GC)

Synonyms

EN300-19236 | AKOS000120159 | BRN 1905113 | NSC 10275 | o-Difluorobenzene | 4-05-00-00637 (Beilstein Handbook Reference) | FT-0606397 | Benzene, 1,2-difluoro- | 1,2-Difluorobenzene, 98% | AI3-52226 | DTXSID2075390 | o-difluoro benzene | ortho-Difluorobenz

Storage

Room temperature

Shipped In

FedEx DG Service

Vue d’ensemble

It undergoes defluorination under very mild conditions by H2 in the presence of NaOAc over rhodium pyridylphosphine and bipyridyl complexes tethered on a silica-supported palladium catalyst.
A solvent useful for electrochemical studies on transition metal complexes.

Specifications

Synonymes

EN300-19236 | AKOS000120159 | BRN 1905113 | NSC 10275 | o-Difluorobenzene | 4-05-00-00637 (Beilstein Handbook Reference) | FT-0606397 | Benzene, 1,2-difluoro- | 1,2-Difluorobenzene, 98% | AI3-52226 | DTXSID2075390 | o-difluoro benzene | ortho-Difluorobenz

Spécifications et pureté

≥98%(GC)

Conditions de stockage de stockage

Room temperature

Expédié en

FedEx DG Service

Pureté

≥98%(GC)

Noms et identifiants

Pubchem Sid

504751858

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504751858

Sourires canoniques

C1=CC=C(C(=C1)F)F

IUPAC Name

1,2-difluorobenzene

InChIKey

GOYDNIKZWGIXJT-UHFFFAOYSA-N

INCHI

1S/C6H4F2/c7-5-3-1-2-4-6(5)8/h1-4H

Isomères SMILES

C1=CC=C(C(=C1)F)F

WGK Allemagne

3

RTECS

CZ5655000

Numéro ONU

1993

Groupe d'emballage

II

Poids moléculaire

114.09

Reaxy-Rn

1905113

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1905113&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Halobenzenes
• Intermediate Tree Nodes: Not available
• Direct Parent: Fluorobenzenes
• Alternative Parents: Aryl fluorides Organofluorides Hydrofluorocarbons Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Fluorobenzene - Aryl halide - Aryl fluoride - Hydrofluorocarbon - Hydrocarbon derivative - Organofluoride - Organohalogen compound - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as fluorobenzenes. These are compounds containing one or more fluorine atoms attached to a benzene ring.
• External Descriptors: difluorobenzene

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

Propriétés chimiques et physiques

• Solubilité: not miscible or difficult to mix in water
• Indice de réfraction: 1.443
• Point d'éclair (°F): 33.8 °F
• Point d'éclair (°C): 1 °C
• Point d'ébullition (°C): 92 °C
• Point de fusion (°C): -34°C
• Poids moléculaire: 114.090 g/mol
• XLogP3: 2.400
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 114.028 Da
• Monoisotopic Mass: 114.028 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 62.900
• 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 ≥98% 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 is classified as dangerous goods and ships via FedEx DG Service. Ground and other economy services are not available, and delivery to some destinations or address types may be restricted.

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

The CAS Number is 367-11-3, the molecular formula is C6H4F2, and the molecular weight is 114.09 g/mol. InChIKey GOYDNIKZWGIXJT-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.