Ácido antraquinona-2-carboxílico - ≥98% , CAS No.117-78-2

CAS: 117-78-2 Cat. No.: A151376 Peso molecular: 252.23 Beilstein Registry Number: 10(3)3640 Número EC: 204-207-9

GRADE & PURITY ≥98%

Synonyms

ácido .beta-antraquinonocarboxílico | Ácido 9,10-dihidro-9,10-dioxo-2-antracenocarboxílico | Q59196332 | Ácido 2-antroico, 9,10-dihidro-9,10-dioxo- | AKOS001482342 | Ácido 9,10-antraquinona 2-carboxílico | Ácido 9,10-antraquinona-2-carboxílico | A803823 |

Storage

Room temperature

Shipped In

Normal

Descripción general

aplicación：
Ácido 2-carboxílico de antraquinona (AQ) como un nuevo mediador de intercambio de electrones y relé de electrones adjuntos para HRP. Se investiga un método eficiente para la generación de peróxido de hidrógeno por fotooxidación aeróbica de 2-propanol utilizando ácido antraquinona-2-carboxílico y oxígeno molecular.

Specifications

Sinónimos

ácido .beta-antraquinonocarboxílico | Ácido 9, 10-dihidro-9, 10-dioxo-2-antracenocarboxílico | Q59196332 | Ácido 2-antroico, 9, 10-dihidro-9, 10-dioxo- | AKOS001482342 | Ácido 9, 10-antraquinona 2-carboxílico | Ácido 9, 10-antraquinona-2-carboxílico | A803823 |

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥98%

Nombres e identificadores

• Pubchem Sid: 488183891
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488183891
• Sonrisas canónicas: C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C=C(C=C3)C(=O)O
• IUPAC Name: 9,10-dioxoanthracene-2-carboxylic acid
• InChIKey: ASDLSKCKYGVMAI-UHFFFAOYSA-N
• INCHI: 1S/C15H8O4/c16-13-9-3-1-2-4-10(9)14(17)12-7-8(15(18)19)5-6-11(12)13/h1-7H,(H,18,19)
• Isómeros SMILES: C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C=C(C=C3)C(=O)O
• WGK Alemania: 3
• Peso molecular: 252.23
• Beilstein: 10(3)3640
• Reaxy-Rn: 2216475
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2216475&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Anthracenes
      • Subclass Anthracenecarboxylic acids and derivatives

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Anthracenes
• Subclass: Anthracenecarboxylic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Anthracenecarboxylic acids
• Alternative Parents: Anthraquinones Naphthalenecarboxylic acids Aryl ketones Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Anthracene carboxylic acid - Anthraquinone - 9,10-anthraquinone - 2-naphthalenecarboxylic acid or derivatives - 2-naphthalenecarboxylic acid - Aryl ketone - Ketone - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aromatic homopolycyclic compound
• Descripción: This compound belongs to the class of organic compounds known as anthracenecarboxylic acids. These are organic compounds containing a carboxylic acid group attached to an anthracene ring system.
• 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

Objetivos asociados (humanos)

NEU2 Tbio Sialidase 2 (382 Activities)

Discover Target: NEU2

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

Objetivos asociados (no humanos)

Ttr Transthyretin (14 Activities)

Discover Target: Ttr

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

Mecanismos de acción

Propiedades químicas y físicas

• Solubilidad: Soluble in hot Acetic acid(almost transparency).
• Punto de fusión (°C): 287-289°C
• Peso molecular: 252.220 g/mol
• XLogP3: 3.000
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 252.042 Da
• Monoisotopic Mass: 252.042 Da
• Topological Polar Surface Area: 71.400 Ų
• Heavy Atom Count: 19
• Formal Charge: 0
• Complexity: 428.000
• 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. Yuanyuan Song, Ziqi Wang, Yijing Long, Yang Mao, Feng Jiang, Yuanyuan Lu.  (2022)  2-Alkyl-anthraquinones inhibit Candida albicans biofilm via inhibiting the formation of matrix and hyphae.  RESEARCH IN MICROBIOLOGY,      [PMID:35550403] [10.1016/j.resmic.2022.103955]

2. Man Chen, Quanhua Cai, Xiangyu Chen, Shaofu Huang, Qinyuan Feng, Tetsuro Majima, Raymond Jianxiong Zeng, Shungui Zhou.  (2022)  Anthraquinone-2-Sulfonate as a Microbial Photosensitizer and Capacitor Drives Solar-to-N2O Production with a Quantum Efficiency of Almost Unity.  ENVIRONMENTAL SCIENCE & TECHNOLOGY,      [PMID:35312317] [10.1021/acs.est.1c08710]

3. Yangyang Liu, Tao Wang, Xiaozhong Fang, Yue Deng, Hanyun Cheng, Aziz-Ur-Rahim Bacha, Iqra Nabi, Liwu Zhang.  (2020)  Brown carbon: An underlying driving force for rapid atmospheric sulfate formation and haze event.  SCIENCE OF THE TOTAL ENVIRONMENT,      [PMID:32464390] [10.1016/j.scitotenv.2020.139415]

4. Lu-Yan Zhang, Chen-Hao Cui, Shan-Shan Yang, Yan Li, Han-Jun Sun, Nan-Qi Ren, Jie Ding.  (2025)  Advanced photocatalytic degradation of highly chlorinated organic wastewater using anthraquinone-modified carbon nitride: Driven by superoxide and dichloride radicals.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2025.159409]

5. Ning Xia, Fengli Gao, Gang Liu, Yong Chang, Lin Liu.  (2024)  Pyrroloquinoline quinone exhibiting peroxidase-mimicking property for colorimetric assays.  ANALYTICA CHIMICA ACTA,      [PMID:39643317] [10.1016/j.aca.2024.343468]

6. Yuxin Li, Shiqi Yang, Zihan Liu, Yiyang Pan, Pengfei Zhang, Zhiqiu Qu, Chao Shan.  (2025)  Enhanced reactivity and electron efficiency of nanoscale zero-valent iron for nitroaromatic compounds reduction through modification with anthraquinone-2-carboxylic acid.  Chemical Engineering Journal Advances,      [PMID:] [10.1016/j.ceja.2025.100835]

7. Jian Cai, Wei Deng, Ziyu Zhu, Long Zheng, Mimi Sun, Chong-Bo Ma, Jing Bai, Xiangjie Bo, Ming Zhou.  (2025)  A Single Carbon Microyarn-Based Integrated Wearable Textile Sweat Sensor Built into a Hook-and-Loop Fastener.  ANALYTICAL CHEMISTRY,      [PMID:40518599] [10.1021/acs.analchem.5c01624]

8. Cai Minghui, Zhang Wenwen, Yao Haixu, Su Huiyu, Cao Yang, Li Jiaxin, Min Xinyu, Cui Feiyun, Zhu Hui.  (2026)  A one-for-four redox probe strategy for multiplex electrochemical POCT of thrombotic biomarkers.  MICROCHIMICA ACTA,  193  (2): (94).  [PMID:41543777] [10.1007/s00604-025-07822-6]

9. Jinyang Chen, Xiaoyu Lin, Wei Wang, Li Gan, Zuliang Chen.  (2026)  Mediated electron transfer in the bio-reduction of graphene oxide by Lysinibacillus sphaericus: Mechanisms and facilitation.  JOURNAL OF POWER SOURCES,      [PMID:] [10.1016/j.jpowsour.2026.239646]

10. Xin Zeng, Ranran Bu, Fengjiao Zhao, Yan Ding, Haizhen Song, Hongming Yin.  (2026)  Rewritable photochromic 2-anthraquinonecarboxylic acid-doped poly(methyl methacrylate) film for information storage.  DYES AND PIGMENTS,      [PMID:] [10.1016/j.dyepig.2026.113752]