Anthracene - ≥96% , CAS No.120-12-7

CAS: 120-12-7 Cat. No.: A108699 Fórmula: C₁₄H₁₀ Peso molecular: 178.23 Beilstein Registry Number: 1905429 Número CE: 204-371-1

GRAU & PUREZA ≥96%

Synonyms

Tetra Olive N2G|acenes|Sterilite hop defoliant|Anthracene polycyclic aromatic compound|Anthracene technical|antraceno|ANTHRACENE [IARC]|Deuterated anthracene|p-Naphthalene|ANTHRACENE (IARC)|A89200_ALDRICH|ANTHRACENE [MI]|Anthracen [German]|Paranaphthalene|34F - WFD F|Azen|antracene|ANTHRACENE|PARANAPTHALENE|AN3|Anthraxcene|ANTHRACENE [HSDB]|Acen|9-Anthracene|Coal tar pitch volatiles: anthracene|Anthracin|Anthracene Zone Refined (number of passes:30)|Anthracene (purified by sublimation)|ANTHRACENE (1,2,3,4,5,6,7,8,9,10-D10)|Anthracene, Reagent|HRACENE|Anthracene, labeled with deuterium|Anthrazen|Anthracen|Anthracene, Practical|Anthracene, Zone Refined (number of passes:30)

Storage

Protected from light,Room temperature

Shipped In

FedEx DG Service

Visão geral

Anthracene derivatives are useful in preparing stable blue-emitting organic electroluminescence devices. It is oxidized to anthracene cis-1,2-dihydrodiol by Mycobacterium sp. strain PYR-12. It forms bis-adducts by -cycloaddition reaction with -fullerene C60.
Anthracene has been shown to be soluble in a variety of binary and ternary mixtures of cyclohexanone, ethyl acetate, and methanol.Anthracene was used to study the photodimerization reaction of anthracene in supercritical CO2.

Especificações

Sinónimos

Tetra Olive N2G | acenes | Sterilite hop defoliant | Anthracene polycyclic aromatic compound | Anthracene technical | antraceno | ANTHRACENE [IARC] | Deuterated anthracene | p-Naphthalene | ANTHRACENE (IARC) | A89200_ALDRICH | ANTHRACENE [MI] | Anthracen [German] | Paranaphthalene | 34F - WFD F | Azen | antracene | ANTHRACENE | PARANAPTHA Show more

Especificações e pureza

≥96%

Condições de armazenamento de armazenamento

Protected from light,Room temperature

Enviado em

FedEx DG Service

Pureza

≥96%

Nomes e identificadores

Pubchem Sid

488180783

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488180783

Sorrisos canónicos

C1=CC=C2C=C3C=CC=CC3=CC2=C1

IUPAC Name

anthracene

InChIKey

MWPLVEDNUUSJAV-UHFFFAOYSA-N

INCHI

1S/C14H10/c1-2-6-12-10-14-8-4-3-7-13(14)9-11(12)5-1/h1-10H

SMILES isoméricas

C1=CC=C2C=C3C=CC=CC3=CC2=C1

WGK Alemanha

2

Número UN

3077

Grupo de embalagem

III

Peso molecular

178.23

Beilstein

1905429

Reaxy-Rn

1905429

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1905429&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Anthracenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Anthracenes
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Anthracenes
• Alternative Parents: Aromatic hydrocarbons Polycyclic hydrocarbons Unsaturated hydrocarbons
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Anthracene - Aromatic hydrocarbon - Polycyclic hydrocarbon - Unsaturated hydrocarbon - Hydrocarbon - Aromatic homopolycyclic compound
• Descrição: This compound belongs to the class of organic compounds known as anthracenes. These are organic compounds containing a system of three linearly fused benzene rings.
• External Descriptors: anthracenes - acene - ortho-fused tricyclic hydrocarbon

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

Alvos associados (humanos)

ESR1 Tclin Estrogen receptor alpha (17718 Activities)

Discover Target: ESR1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

ALOX5 Tclin Arachidonate 5-lipoxygenase (6568 Activities)

Discover Target: ALOX5

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

VDR Tclin Vitamin D receptor (26531 Activities)

Discover Target: VDR

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

HaCaT (4069 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Alvos associados (não humanos)

Ppard Peroxisome proliferator-activated receptor delta (358 Activities)

Discover Target: Ppard

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mecanismos de ação

Propriedades químicas e físicas

• Solubilidade: Soluble in ethanol and ether, insoluble in water
• Sensibilidade: Light sensitive.
• Ponto de inflamação (°F): 249.8 °F - closed cup
• Ponto de inflamação (°C): 121°C
• Ponto de ebulição (°C): 342°C
• Ponto de fusão (°C): 215-216°C
• Peso molecular: 178.230 g/mol
• XLogP3: 4.400
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 178.078 Da
• Monoisotopic Mass: 178.078 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 154.000
• 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

Perguntas frequentes

What is the purity of this product?

This product is supplied at ≥96% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature, protected from light. The material is light-sensitive — keep it in its original opaque or amber container.

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 120-12-7, the molecular formula is C14H10, and the molecular weight is 178.23 g/mol. InChIKey MWPLVEDNUUSJAV-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.