4,7-Dihidroxi-1,10-fenantrolina - ≥98% , CAS No.3922-40-5

CAS: 3922-40-5 Cat. No.: D119919 Peso molecular: 212.21 Número EC: 223-493-6

GRADE & PURITY ≥98%

Synonyms

A846126 | Oprea1_631021 | SCHEMBL19318056 | 4,7-Dihydroxy-1,10-phenanthroline, Dye content >=30 % | D3869 | 4,7-Dihydroxy-1,10-phenanthroline | SLIBCJURSADKPV-UHFFFAOYSA-N | MFCD00004975 | NCGC00246264-01 | F71669 | SCHEMBL1073354 | 1,10-Phenanthroline-4,

Storage

Almacenar a -20°C,cargado con argón

Shipped In

Hielera + almohadillas de hielo

Specifications

Sinónimos

A846126 | Oprea1_631021 | SCHEMBL19318056 | 4, 7-Dihydroxy-1, 10-phenanthroline, Dye content >=30 % | D3869 | 4, 7-Dihydroxy-1, 10-phenanthroline | SLIBCJURSADKPV-UHFFFAOYSA-N | MFCD00004975 | NCGC00246264-01 | F71669 | SCHEMBL1073354 | 1, 10-Phenanthroline-4,

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Almacenar a -20°C, cargado con argón

Enviado en

Hielera + almohadillas de hielo

Pureza

≥98%

Nombres e identificadores

• Pubchem Sid: 488185416
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488185416
• Sonrisas canónicas: C1=CC2=C(C3=C1C(=O)C=CN3)NC=CC2=O
• IUPAC Name: 1,10-dihydro-1,10-phenanthroline-4,7-dione
• InChIKey: SLIBCJURSADKPV-UHFFFAOYSA-N
• INCHI: 1S/C12H8N2O2/c15-9-3-5-13-11-7(9)1-2-8-10(16)4-6-14-12(8)11/h1-6H,(H,13,15)(H,14,16)
• Isómeros SMILES: C1=CC2=C(C3=C1C(=O)C=CN3)NC=CC2=O
• WGK Alemania: 3
• Peso molecular: 212.21
• Reaxy-Rn: 186518
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=186518&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Phenanthrolines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Phenanthrolines
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenanthrolines
• Alternative Parents: Hydroquinolones Hydroquinolines Pyridines and derivatives Benzenoids Vinylogous amides Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: 1,10-phenanthroline - Dihydroquinolone - Dihydroquinoline - Quinoline - Pyridine - Benzenoid - Heteroaromatic compound - Vinylogous amide - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
• Descripción: This compound belongs to the class of organic compounds known as phenanthrolines. These are aromatic polycyclic compounds containing the phenanthroline skeleton, which is a derivative of phenanthrene, and consists of two pyridine rings non-linearly joined by a benzene ring.
• 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)

CCR1 Tchem C-C chemokine receptor type 1 (1730 Activities)

Discover Target: CCR1

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

CCR5 Tclin C-C chemokine receptor type 5 (5640 Activities)

Discover Target: CCR5

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

Objetivos asociados (no 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 acción

Propiedades químicas y físicas

• Solubilidad: Insoluble in water.
• Sensibilidad: Hygroscopic;Heat sensitive;Air sensitive
• Punto de fusión (°C): >300°C
• Peso molecular: 212.200 g/mol
• XLogP3: 1.200
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 212.059 Da
• Monoisotopic Mass: 212.059 Da
• Topological Polar Surface Area: 58.200 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 362.000
• 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. Dazhuang Xu, Xin Zhou, Qiang Huang, Jianwen Tian, Hongye Huang, Qing Wan, Yanfeng Dai, Yuanqing Wen, Xiaoyong Zhang, Yen Wei.  (2017)  Facile fabrication of biodegradable lanthanide ions containing fluorescent polymeric nanoparticles: Characterization, optical properties and biological imaging.  MATERIALS CHEMISTRY AND PHYSICS,      [PMID:] [10.1016/j.matchemphys.2017.12.068]

2. Dongbo Chen, Yu-e Shi, Song Shen, Song Liu, Dongpeng Yan, Zhenguang Wang.  (2025)  Achieving High-Temperature Resistant Afterglow by Modulating Dual-Mode Emission of Organic Emitters through Defects Engineering.  Small,      [PMID:40018796] [10.1002/smll.202409689]

3. Chenglong Ji, Jing Ma, Henggang Wang, Song Liu, Yu-e Shi, Peng Zhang, Zhenguang Wang.  (2025)  Efficient Visible Light Activated Afterglow Through Stabilizing Excited Dimers Via a Melt-Injection Reaction for Multiple Applications.  Advanced Optical Materials,      [PMID:] [10.1002/adom.202502328]