4-(4-Bromophenyl)dibenzofuran - ≥98%(GC) , CAS No.955959-84-9

CAS: 955959-84-9 Cat. No.: B152998 Formula: C₁₈H₁₁BrO Peso molecolare: 323.19 Numero EC: 815-536-8

GRADE & PURITY ≥98%(GC)

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

Sinonimi

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

Specifiche e purezza

≥98%(GC)

Condizioni di conservazione di stoccaggio

Room temperature

Spedito in

Normal

Purezza

≥98%(GC)

Nomi e identificatori

Pubchem Sid

504771715

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504771715

Sorrisi canonici

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

Isomeri SMILES

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

Peso molecolare

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
    • Classe Benzofurans
      • Subclass Phenylbenzofurans

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: 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
• Descrizione: 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

Proprietà chimiche e fisiche

• Punto di fusione (°C): 99.0 - 103.0 °C
• Peso molecolare: 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

Domande frequenti

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 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.