(4-methoxycarbonyl-2,6-dimethyl-phenyl) acridine-9-carboxylate - ≥97% , CAS No.1156506-80-7

CAS: 1156506-80-7 Cat. No.: A627017 Molecular Weight: 385.41 PubChem CID: 87479209

GRADE & PURITY ≥97%

Synonyms

1156506-80-7 | 4-(Methoxycarbonyl)-2,6-dimethylphenyl acridine-9-carboxylate | (4-methoxycarbonyl-2,6-dimethylphenyl) acridine-9-carboxylate | 2,6-Dimethyl-4-(methoxycarbonyl)phenyl Acridine-9-carboxylate | SCHEMBL3092289 | (4-methoxycarbonyl-2,6-dimethyl

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyms

1156506-80-7 | 4-(Methoxycarbonyl)-2, 6-dimethylphenyl acridine-9-carboxylate | (4-methoxycarbonyl-2, 6-dimethylphenyl) acridine-9-carboxylate | 2, 6-Dimethyl-4-(methoxycarbonyl)phenyl Acridine-9-carboxylate | SCHEMBL3092289 | (4-methoxycarbonyl-2, 6-dimethyl

Specifications & Purity

≥97%

Storage

Room temperature

Shipped In

Normal

Purity

≥97%

Names and Identifiers

• Canonical Smiles: CC1=CC(=CC(=C1OC(=O)C2=C3C=CC=CC3=NC4=CC=CC=C42)C)C(=O)OC
• IUPAC Name: (4-methoxycarbonyl-2,6-dimethylphenyl) acridine-9-carboxylate
• InChIKey: DOUHCXDGBDELMK-UHFFFAOYSA-N
• INCHI: 1S/C24H19NO4/c1-14-12-16(23(26)28-3)13-15(2)22(14)29-24(27)21-17-8-4-6-10-19(17)25-20-11-7-5-9-18(20)21/h4-13H,1-3H3
• Isomeric SMILES: CC1=CC(=CC(=C1OC(=O)C2=C3C=CC=CC3=NC4=CC=CC=C42)C)C(=O)OC
• PubChem CID: 87479209
• Molecular Weight: 385.41

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Class Quinolines and derivatives
      • Subclass Benzoquinolines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Quinolines and derivatives
• Subclass: Benzoquinolines
• Intermediate Tree Nodes: Not available
• Direct Parent: Acridines
• Alternative Parents: Phenol esters Benzoic acid esters Pyridinecarboxylic acids m-Xylenes Phenoxy compounds Benzoyl derivatives Methyl esters Heteroaromatic compounds Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Acridine - Benzoate ester - Phenol ester - Benzoic acid or derivatives - Pyridine carboxylic acid or derivatives - Pyridine carboxylic acid - Phenoxy compound - M-xylene - Xylene - Benzoyl - Monocyclic benzene moiety - Benzenoid - Pyridine - Heteroaromatic compound - Methyl ester - Carboxylic acid ester - Azacycle - Carboxylic acid derivative - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as acridines. These are organic compounds containing the acridine moiety, a linear tricyclic heterocycle which consists of two benzene rings joined by a pyridine 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