6-Quinolinecarboxaldehyde - ≥98% , CAS No.4113-04-6

CAS: 4113-04-6 Cat. No.: Q160817 Summenformel: C₁₀H₇NO Molekulargewicht: 157.17 EG-Nummer: 689-110-3 PubChem CID: 765653

GRADE & PURITY ≥98%

Synonyms

6-quinoline carboxaldehyde | AM20051168 | AC-7403 | 6-FORMYL-1-AZANAPHTHALENE | VUAOIXANWIFYCU-UHFFFAOYSA-N | DTXSID60354177 | 6-FORMYLQUINOLINE | STK346857 | 6-Quinolinecarboxaldehyde | EN300-00995 | quinoline-6-carboxaldehyde | 6-Quinolinecarbaldehyde |

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Synonyme

6-quinoline carboxaldehyde | AM20051168 | AC-7403 | 6-FORMYL-1-AZANAPHTHALENE | VUAOIXANWIFYCU-UHFFFAOYSA-N | DTXSID60354177 | 6-FORMYLQUINOLINE | STK346857 | 6-Quinolinecarboxaldehyde | EN300-00995 | quinoline-6-carboxaldehyde | 6-Quinolinecarbaldehyde |

Spezifikationen & Reinheit

≥98%

Storage

Store at 2-8°C,Argon charged

Verschickt in

Wet ice

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Reinheit

≥98%

Namen und Kennungen

Pubchem Sid

488191447

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488191447

Kanonisches Lächeln

C1=CC2=C(C=CC(=C2)C=O)N=C1

IUPAC Name

quinoline-6-carbaldehyde

InChIKey

VUAOIXANWIFYCU-UHFFFAOYSA-N

INCHI

1S/C10H7NO/c12-7-8-3-4-10-9(6-8)2-1-5-11-10/h1-7H

Isomere SMILES

C1=CC2=C(C=CC(=C2)C=O)N=C1

PubChem CID

765653

Molekulargewicht

157.17

Reaxy-Rn

113274

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Klasse Quinolines and derivatives

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Klasse: Quinolines and derivatives
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Quinolines and derivatives
• Alternative Parents: Aryl-aldehydes Pyridines and derivatives Benzenoids Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Quinoline - Aryl-aldehyde - Benzenoid - Pyridine - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aldehyde - Aromatic heteropolycyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as quinolines and derivatives. These are compounds containing a quinoline moiety, which consists of a benzene ring fused to a pyrimidine ring to form benzo[b]azabenzene.
• 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

Chemische und physikalische Eigenschaften

• Empfindlichkeit: Air Sensitive
• Siedepunkt (°C): 314.3°C at 760 mmHg
• Schmelzpunkt (°C): 76 °C
• Molekulargewicht: 157.170 g/mol
• XLogP3: 1.600
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 157.053 Da
• Monoisotopic Mass: 157.053 Da
• Topological Polar Surface Area: 30.000 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 169.000
• 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