Dibenzo[def,p]chrysene - ≥97% , CAS No.191-30-0

CAS: 191-30-0 Cat. No.: D134337 Summenformel: C₂₄H₁₄ Molekulargewicht: 302.37 Beilstein Registry Number: 2054068 EG-Nummer: 205-886-4

QUALITÄT & REINHEIT ≥97%

Synonyms

JNTHRSHGARDABO-UHFFFAOYSA-N | Dibenzo[a,d]pyrene | 1,2,9,10-Dibenzopyrene | 4,5:6,7-Dibenzpyrene | Dibenzo[def,p]chrysene | EINECS 205-886-4 | Dibenzo[a,l]pyrene | 2,3:4,5-Dibenzpyrene | 2-DECYLDODECANOICACID | Dibenzo[d,f,p]chrysene | BRN 2054068 | CHEBI

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Übersicht

Dibenzo[a,l]pyrene is a polycyclic aromatic hydrocarbon (PAH) found in cigarette smoke condensate and coal combustion. It is an environmental pollutant and a potent carcinogen known to induce tumors in rat mammary gland, mouse skin, lungs and liver.

Purpose

Dibenzo[a,l]pyrene may be used as an analytical standard for the determination of the analyte in crude extracts of environmental samples,water samples and Chinese coal fly ash CRM by chromatography and spectrometry techniques.

Spezifikationen

Synonyme

JNTHRSHGARDABO-UHFFFAOYSA-N | Dibenzo[a,d]pyrene | 1,2,9,10-Dibenzopyrene | 4,5:6,7-Dibenzpyrene | Dibenzo[def,p]chrysene | EINECS 205-886-4 | Dibenzo[a,l]pyrene | 2,3:4,5-Dibenzpyrene | 2-DECYLDODECANOICACID | Dibenzo[d,f,p]chrysene | BRN 2054068 | CHEBI

Spezifikationen & Reinheit

≥97%

Storage

Store at 2-8°C,Argon charged

Verschickt in

Wet ice

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Reinheit

≥97%

Namen und Kennungen

Kanonisches Lächeln

C1=CC=C2C(=C1)C=C3C=CC4=C5C3=C2C6=CC=CC=C6C5=CC=C4

IUPAC Name

hexacyclo[10.10.2.02,7.08,24.015,23.017,22]tetracosa-1(23),2,4,6,8,10,12(24),13,15,17,19,21-dodecaene

InChIKey

JNTHRSHGARDABO-UHFFFAOYSA-N

INCHI

1S/C24H14/c1-2-8-18-16(6-1)14-17-13-12-15-7-5-11-20-19-9-3-4-10-21(19)24(18)23(17)22(15)20/h1-14H

Isomere SMILES

C1=CC=C2C(=C1)C=C3C=CC4=C5C3=C2C6=CC=CC=C6C5=CC=C4

WGK Deutschland

3

UN-Nummer

2811

Verpackungsgruppe

I

Molekulargewicht

302.37

Beilstein

2054068

Reaxy-Rn

2054068

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2054068&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Klasse Pyrenes
      • Subclass Benzopyrenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Klasse: Pyrenes
• Subclass: Benzopyrenes
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzopyrenes
• Alternative Parents: Triphenylenes Chrysenes Anthracenes Aromatic hydrocarbons Polycyclic hydrocarbons Unsaturated hydrocarbons
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Benzo-e-pyrene - Benzo-a-pyrene - Triphenylene - Chrysene - Phenanthrene - Anthracene - Aromatic hydrocarbon - Polycyclic hydrocarbon - Unsaturated hydrocarbon - Hydrocarbon - Aromatic homopolycyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as benzopyrenes. These are organic compounds containing a benzene fused to a pyrene(benzo[def]phenanthrene) ring system.
• External Descriptors: ortho- and peri-fused polycyclic arene

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

• Empfindlichkeit: Moisture sensitive
• Molekulargewicht: 302.400 g/mol
• XLogP3: 7.200
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 302.11 Da
• Monoisotopic Mass: 302.11 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 24
• Formal Charge: 0
• Complexity: 480.000
• 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 ≥97% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at 2–8 °C under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.

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

The CAS Number is 191-30-0, the molecular formula is C24H14, and the molecular weight is 302.37 g/mol. InChIKey JNTHRSHGARDABO-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.