1,4-Anthraquinone - ≥95%(HPLC) , CAS No.635-12-1

CAS: 635-12-1 Cat. No.: A151574 Peso molecular: 208.22

GRADE & PURITY ≥95%(HPLC)

Synonyms

AS-19220 | EN300-202117 | A12708 | anthracene-1,4-dione | EINECS 211-228-7 | FT-0606760 | MFCD00013724 | DTXSID10212899 | 1,4-Anthracenedione | HY-W077242 | 1,4-Dioxoanthracene | NSC 104530 | 1,4-Anthraquinone | 1,4-Anthracenequinone | 1,4-dihydroanthrace

Storage

Room temperature

Shipped In

Normal

Descripción general

1,4-Anthraquinone is a potent anticancer agent. 1,4-Anthraquinone blocks nucleoside transport, inhibits macromolecule synthesis, induces DNA fragmentation, and decreases the growth and viability of cancer cells. 1,4-Anthraquinone can be used to research anti-leukemia.

Specifications

Sinónimos

AS-19220 | EN300-202117 | A12708 | anthracene-1, 4-dione | EINECS 211-228-7 | FT-0606760 | MFCD00013724 | DTXSID10212899 | 1, 4-Anthracenedione | HY-W077242 | 1, 4-Dioxoanthracene | NSC 104530 | 1, 4-Anthraquinone | 1, 4-Anthracenequinone | 1, 4-dihydroanthrace

Especificaciones y pureza

≥95%(HPLC)

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Tipo de acción

INHIBITOR

Pureza

≥95%(HPLC)

Nombres e identificadores

• Pubchem Sid: 488184327
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488184327
• Sonrisas canónicas: C1=CC=C2C=C3C(=O)C=CC(=O)C3=CC2=C1
• IUPAC Name: anthracene-1,4-dione
• InChIKey: LSOTZYUVGZKSHR-UHFFFAOYSA-N
• INCHI: 1S/C14H8O2/c15-13-5-6-14(16)12-8-10-4-2-1-3-9(10)7-11(12)13/h1-8H
• Isómeros SMILES: C1=CC=C2C=C3C(=O)C=CC(=O)C3=CC2=C1
• Peso molecular: 208.22
• Reaxy-Rn: 1871197
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1871197&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Anthracenes
      • Subclass Anthraquinones

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Anthracenes
• Subclass: Anthraquinones
• Intermediate Tree Nodes: Not available
• Direct Parent: Anthraquinones
• Alternative Parents: Quinones Aryl ketones Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: 1,4-anthraquinone - Anthraquinone - Aryl ketone - Quinone - Ketone - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aromatic homopolycyclic compound
• Descripción: This compound belongs to the class of organic compounds known as anthraquinones. These are organic compounds containing either anthracene-9,10-quinone, 1,4-anthraquinone, or 1,2-anthraquinone.
• 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

Propiedades químicas y físicas

• Solubilidad: Insoluble in water.
• Sensibilidad: Hygroscopic
• Punto de fusión (°C): 218℃
• Peso molecular: 208.210 g/mol
• XLogP3: 3.000
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 208.052 Da
• Monoisotopic Mass: 208.052 Da
• Topological Polar Surface Area: 34.100 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 322.000
• 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

Referencias

1. Zhongcheng Wang, Jingsong Feng, Xiaoyu Liu, Hao Guo.  (2022)  Preparation Methods and Performance Analysis of Polyanthra-Quinone/Carbon Nanotube Composites for Capturing Carbon Dioxide.  Atmosphere,  13  (4): (543).  [PMID:] [10.3390/atmos13040543]