6,7-dimethoxyquinoline - ≥97% , CAS No.67278-27-7

CAS: 67278-27-7 Cat. No.: D634339 分子式: C₁₁H₁₁NO₂ 分子量: 189.21 PubChem CID: 10856252

GRADE & PURITY ≥97%

Synonyms

PCDPMVJGEGAJBI-UHFFFAOYSA-N | SB21494 | Z1813143006 | AKOS022889862 | 6,7-dimethoxyquinoline | 6,7-Dimethoxy-quinoline | EN300-7442489 | P17810 | BDBM50039046 | SCHEMBL4299023 | Quinoline, 6,7-dimethoxy- | AMY35065 | AS-54369 | SY324004 | DTXSID80446028 |

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Specifications

同義語

PCDPMVJGEGAJBI-UHFFFAOYSA-N | SB21494 | Z1813143006 | AKOS022889862 | 6,7-dimethoxyquinoline | 6,7-Dimethoxy-quinoline | EN300-7442489 | P17810 | BDBM50039046 | SCHEMBL4299023 | Quinoline, 6,7-dimethoxy- | AMY35065 | AS-54369 | SY324004 | DTXSID80446028 |

仕様と純度

≥97%

保管条件

Store at -20°C

入荷

Ice chest + Ice pads

この製品は冷冷この冷このこの製品の運送が必要です。地上およびその他の経済サービスは利用できません。

純度

≥97%

名前と識別子

• パブケム・シド: 528762096
• カノニカル・スマイル: COC1=C(C=C2C(=C1)C=CC=N2)OC
• IUPAC Name: 6,7-dimethoxyquinoline
• InChIKey: PCDPMVJGEGAJBI-UHFFFAOYSA-N
• INCHI: 1S/C11H11NO2/c1-13-10-6-8-4-3-5-12-9(8)7-11(10)14-2/h3-7H,1-2H3
• 異性体SMILES: COC1=C(C=C2C(=C1)C=CC=N2)OC
• 代替CAS番号: 67278-27-7
• PubChem CID: 10856252
• 分子量: 189.21

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• 分類: Quinolines and derivatives
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Quinolines and derivatives
• Alternative Parents: Anisoles Alkyl aryl ethers Pyridines and derivatives Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Quinoline - Phenol ether - Anisole - Alkyl aryl ether - Benzenoid - Pyridine - Heteroaromatic compound - Azacycle - Ether - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
• 説明: 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

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作用メカニズム

化学的性質と物理的性質

• 分子量: 189.210 g/mol
• XLogP3: 2.100
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 189.079 Da
• Monoisotopic Mass: 189.079 Da
• Topological Polar Surface Area: 31.400 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 186.000
• 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