Anthracene - ≥96% , CAS No.120-12-7

CAS: 120-12-7 Cat. No.: A108699 分子式: C₁₄H₁₀ 分子量: 178.23 Beilstein Registry Number: 1905429 EC番号: 204-371-1

グレード＆純度 ≥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

概要

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.

仕様

同義語

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 もっと見る

仕様と純度

≥96%

保管条件

Protected from light,Room temperature

入荷

FedEx DG Service

純度

≥96%

名前と識別子

パブケム・シド

488180783

パブケム・シド・ウル

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

カノニカル・スマイル

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

異性体SMILES

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

WGKドイツ

2

UN番号

3077

包装グループ

III

分子量

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
    • 分類 Anthracenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• 分類: 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
• 説明: 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

関連ターゲット（人間）

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

関連ターゲット（非人間）

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

作用メカニズム

化学的性質と物理的性質

• 溶解度: Soluble in ethanol and ether, insoluble in water
• 感度: Light sensitive.
• 引火点（°F）: 249.8 °F - closed cup
• 引火点（°C）: 121°C
• 沸点（°C）: 342°C
• 融点（°C）: 215-216°C
• 分子量: 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

よくある質問

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.