4-(4-Bromophenyl)dibenzofuran - ≥99% , CAS No.955959-84-9

CAS: 955959-84-9 Cat. No.: B398472 Summenformel: C₁₈H₁₁BrO Molekulargewicht: 323.19 EG-Nummer: 815-536-8

GRADE & PURITY ≥99%

Synonyms

4-(4-Bromophenyl)dibenzo[b,d]furan | DS-6502 | MFCD19441306 | 4-(4-bromophenyl)-dibenzo[b]furan | C77300 | OL10243 | SY055369 | AMY1106 | DTXSID30730863 | A853726 | RIPZSADLUWTEFQ-UHFFFAOYSA-N | 4-(4'-bromophenyl)dibenzofuran | 4-(4-bromophenyl)dibenzofur

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyme

4-(4-Bromophenyl)dibenzo[b,d]furan | DS-6502 | MFCD19441306 | 4-(4-bromophenyl)-dibenzo[b]furan | C77300 | OL10243 | SY055369 | AMY1106 | DTXSID30730863 | A853726 | RIPZSADLUWTEFQ-UHFFFAOYSA-N | 4-(4'-bromophenyl)dibenzofuran | 4-(4-bromophenyl)dibenzofur

Spezifikationen & Reinheit

≥99%

Storage

Room temperature

Verschickt in

Normal

Reinheit

≥99%

Namen und Kennungen

Kanonisches Lächeln

C1=CC=C2C(=C1)C3=C(O2)C(=CC=C3)C4=CC=C(C=C4)Br

IUPAC Name

4-(4-bromophenyl)dibenzofuran

InChIKey

RIPZSADLUWTEFQ-UHFFFAOYSA-N

INCHI

1S/C18H11BrO/c19-13-10-8-12(9-11-13)14-5-3-6-16-15-4-1-2-7-17(15)20-18(14)16/h1-11H

Isomere SMILES

C1=CC=C2C(=C1)C3=C(O2)C(=CC=C3)C4=CC=C(C=C4)Br

Molekulargewicht

323.19

Reaxy-Rn

14346140

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=14346140&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Klasse Benzofurans
      • Subclass Phenylbenzofurans

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Klasse: Benzofurans
• Subclass: Phenylbenzofurans
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenylbenzofurans
• Alternative Parents: Dibenzofurans Bromobenzenes Aryl bromides Heteroaromatic compounds Furans Oxacyclic compounds Organooxygen compounds Organobromides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Phenylbenzofuran - Dibenzofuran - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Furan - Oxacycle - Organohalogen compound - Hydrocarbon derivative - Organic oxygen compound - Organobromide - Organooxygen compound - Aromatic heteropolycyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as phenylbenzofurans. These are organic aromatic compounds that contain a phenyl group attached to a benzofuran moiety. Benzofuran is a bicyclic compound containing a benzene fused to a furan.
• 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

Chemische und physikalische Eigenschaften

• Schmelzpunkt (°C): 99.0 - 103.0 °C
• Molekulargewicht: 323.200 g/mol
• XLogP3: 6.000
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 321.999 Da
• Monoisotopic Mass: 321.999 Da
• Topological Polar Surface Area: 13.100 Ų
• Heavy Atom Count: 20
• Formal Charge: 0
• Complexity: 336.000
• 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

Häufig gestellte Fragen

What is the purity of this product?

This product is supplied at ≥99% purity (chemical assay). 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 955959-84-9, the molecular formula is C18H11BrO, and the molecular weight is 323.19 g/mol. InChIKey RIPZSADLUWTEFQ-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.