Acridine-9-carboxaldehyde - ≥97% , CAS No.885-23-4

CAS: 885-23-4 Cat. No.: A469809 분자식: C₁₄H₉NO 분자량: 207.23 EC 번호: 804-978-7

GRADE & PURITY ≥97%

Synonyms

FT-0709258 | DTXSID50237081 | Acridine-9-carbaldehyde | UNII-5XN5ZGH695 | 9-Acridinecarboxaldehyde(8ci)(9ci) | 9-Formylacridine | Q27456991 | 9-Acridinecarboxaldehyde | Acridine-9-carboxaldehyde, 97% | AKOS015904343 | 9-ACRIDINOYL | 9-Acridinealdehyde | 9

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

개요

Acridine-9-carboxaldehyde (Acridine-9-carbaldehyde) is a bioactive compound with potential antibacterial and antitumor activities. Acridine-9-carboxaldehyde is widely used as a building block in compound development to synthesize various bioactive derivatives. Acridine-9-carboxaldehyde exhibits significant cytotoxicity against certain cancer cells, making it an important candidate in cancer inhibition research.

Specifications

동의어

FT-0709258 | DTXSID50237081 | Acridine-9-carbaldehyde | UNII-5XN5ZGH695 | 9-Acridinecarboxaldehyde(8ci)(9ci) | 9-Formylacridine | Q27456991 | 9-Acridinecarboxaldehyde | Acridine-9-carboxaldehyde, 97% | AKOS015904343 | 9-ACRIDINOYL | 9-Acridinealdehyde | 9

사양 및 순도

≥97%

보관 조건

Store at 2-8°C,Argon charged

배송

Wet ice

이 제품은 콜드 체인 배송이 필요합니다.지상 및 기타 경제 서비스는 사용할 수 없습니다.

순수함

≥97%

이름과 식별자

• 정식 스마일: C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)C=O
• IUPAC Name: acridine-9-carbaldehyde
• InChIKey: ISOCABSXIKQOOV-UHFFFAOYSA-N
• INCHI: 1S/C14H9NO/c16-9-12-10-5-1-3-7-13(10)15-14-8-4-2-6-11(12)14/h1-9H
• 이성체 SMILES: C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)C=O
• WGK 독일: 3
• 분자량: 207.23
• Reaxy-Rn: 138836
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=138836&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• 분류: Quinolines and derivatives
• Subclass: Benzoquinolines
• Intermediate Tree Nodes: Not available
• Direct Parent: Acridines
• Alternative Parents: Pyridine carboxaldehydes Aryl-aldehydes Benzenoids Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Acridine - 4-pyridine carboxaldehyde - Aryl-aldehyde - Pyridine - Benzenoid - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Aldehyde - Aromatic heteropolycyclic compound
• 설명: 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

화학 및 물리적 특성

• 녹는점(°C): 144-149 °C
• 분자량: 207.230 g/mol
• XLogP3: 3.000
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 207.068 Da
• Monoisotopic Mass: 207.068 Da
• Topological Polar Surface Area: 30.000 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 243.000
• 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