9,10-Dimethylanthracene - ≥94% , CAS No.781-43-1

CAS: 781-43-1 Cat. No.: D106357 Fórmula: C₁₆H₁₄ Peso molecular: 206.28 Beilstein Registry Number: 1909028 Número CE: 212-308-4

GRADE & PURITY ≥94%

Synonyms

HSDB 4324 | D0252 | InChI=1/C16H14/c1-11-13-7-3-5-9-15(13)12(2)16-10-6-4-8-14(11)16/h3-10H,1-2H | DI986077VR | 9:10-Dimethylanthracene | LS-14469 | SB66498 | A865092 | GNF-Pf-2329 | NSC4220 | NSC-4220 | 9,10-Dimethylanthracene, analytical standard | 9-10-

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

HSDB 4324 | D0252 | InChI=1/C16H14/c1-11-13-7-3-5-9-15(13)12(2)16-10-6-4-8-14(11)16/h3-10H,1-2H | DI986077VR | 9:10-Dimethylanthracene | LS-14469 | SB66498 | A865092 | GNF-Pf-2329 | NSC4220 | NSC-4220 | 9,10-Dimethylanthracene, analytical standard | 9-10-

Especificações e pureza

≥94%

Condições de armazenamento de armazenamento

Room temperature

Enviado em

Normal

Pureza

≥94%

Nomes e identificadores

Pubchem Sid

488181789

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488181789

Sorrisos canónicos

CC1=C2C=CC=CC2=C(C3=CC=CC=C13)C

IUPAC Name

9,10-dimethylanthracene

InChIKey

JTGMTYWYUZDRBK-UHFFFAOYSA-N

INCHI

1S/C16H14/c1-11-13-7-3-5-9-15(13)12(2)16-10-6-4-8-14(11)16/h3-10H,1-2H3

SMILES isoméricas

CC1=C2C=CC=CC2=C(C3=CC=CC=C13)C

WGK Alemanha

3

RTECS

CA9685000

Peso molecular

206.28

Beilstein

1909028

Reaxy-Rn

1909028

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1909028&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: 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

Alvos associados (não humanos)

Plasmodium falciparum (966862 Activities)

Explore this target

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 Toluene. Insoluble in water.
• Ponto de ebulição (°C): 140-142°C
• Ponto de fusão (°C): 180-185°C
• Peso molecular: 206.280 g/mol
• XLogP3: 5.700
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 206.11 Da
• Monoisotopic Mass: 206.11 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 194.000
• 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 ≥94% 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 781-43-1, the molecular formula is C16H14, and the molecular weight is 206.28 g/mol. InChIKey JTGMTYWYUZDRBK-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.