3,4,7,8-Tetramethyl-1,10-phenanthroline - ≥98%(HPLC) , CAS No.1660-93-1

CAS: 1660-93-1 Cat. No.: T122871 Molecular Weight: 236.31 Beilstein Registry Number: 171279 EC Number: 216-762-4 PubChem CID: 74265

GRADE & PURITY ≥98%(HPLC)

Synonyms

Cyclopropane carboxylic acid | Z2768172030 | AC1714 | 3,4,7,8-tetramethyl-1,10-phenanthrolin | SY004672 | 3,4,7,8-Me4Phenan | 3,4,7,8-tetramethyl-1,10-phenantroline | AS-15524 | W-107928 | 1,2-Diamino-9,10-anthracenedione | 3,4,7,8-Tetramethyl-1,10-diazap

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyms

Cyclopropane carboxylic acid | Z2768172030 | AC1714 | 3, 4, 7, 8-tetramethyl-1, 10-phenanthrolin | SY004672 | 3, 4, 7, 8-Me4Phenan | 3, 4, 7, 8-tetramethyl-1, 10-phenantroline | AS-15524 | W-107928 | 1, 2-Diamino-9, 10-anthracenedione | 3, 4, 7, 8-Tetramethyl-1, 10-diazap

Specifications & Purity

≥98%(HPLC)

Storage

Room temperature

Shipped In

Normal

Purity

≥98%(HPLC)

Names and Identifiers

• Pubchem Sid: 504754792
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504754792
• Canonical Smiles: CC1=CN=C2C(=C1C)C=CC3=C(C(=CN=C32)C)C
• IUPAC Name: 3,4,7,8-tetramethyl-1,10-phenanthroline
• InChIKey: NPAXPTHCUCUHPT-UHFFFAOYSA-N
• INCHI: 1S/C16H16N2/c1-9-7-17-15-13(11(9)3)5-6-14-12(4)10(2)8-18-16(14)15/h5-8H,1-4H3
• Isomeric SMILES: CC1=CN=C2C(=C1C)C=CC3=C(C(=CN=C32)C)C
• WGK Germany: 3
• PubChem CID: 74265
• Molecular Weight: 236.31
• Beilstein: 171279
• Reaxy-Rn: 171279

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Class Phenanthrolines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Phenanthrolines
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenanthrolines
• Alternative Parents: Quinolines and derivatives Methylpyridines Benzenoids Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: 1,10-phenanthroline - Quinoline - Methylpyridine - Benzenoid - Pyridine - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteropolycyclic compound
• Description: 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

Associated Targets(Human)

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

Associated Targets(non-human)

Histidine-rich protein (528 Activities)

Explore this target

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

Plasmodium falciparum (966862 Activities)

Explore this target

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

Ferriprotoporphyrin IX (165 Activities)

Explore this target

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

Mechanisms of Action

Chemical and Physical Properties

• Solubility: Soluble in 1,4-dioxane, acetone, dichloromethane, N,N-dimethylformamide, N,N-dimethylacetamide, methanol and hot toluene.
• Melt Point(°C): 277-280°C
• Molecular Weight: 236.310 g/mol
• XLogP3: 3.900
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 236.131 Da
• Monoisotopic Mass: 236.131 Da
• Topological Polar Surface Area: 25.800 Ų
• Heavy Atom Count: 18
• Formal Charge: 0
• Complexity: 273.000
• 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

References

1. H. C. Guo, R. H. Zheng, H. J. Jiang.  (2012)  Improved Synthesis of 2,9-Dichloro-1,10-phenanthroline.  ORGANIC PREPARATIONS AND PROCEDURES INTERNATIONAL,      [PMID:] [10.1080/00304948.2012.697745]

2. Song Zhang, Yucong Zhou, Zhitao Shen, Yingying Li, Jian Song, Yicong Gao, Zezhi Wang, Bohao Zhang, Chong Chen, Rong Liu, Ying Liu, Ruirui Cao, Huilin Li, Fumin Li.  (2025)  High-efficiency and stable perovskite solar cells via bidentate chelation for facet-engineered growth of FAPbI3 (111) crystals.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2025.164079]