8-Hydroxyquinaldine - ≥98% , CAS No.826-81-3

CAS: 826-81-3 Cat. No.: H111087 분자식: C₁₀H₉NO 분자량: 159.18 Beilstein Registry Number: 119194 EC 번호: 212-562-6

등급 & 순도 ≥98%

Synonyms

8-HYDROXY-2-METHYLQUINOLINE|HYDROXY-2-METHYLQUINOLINE, 8-|2-Methyl-oxine|8-Hydroxyquinaldine; 8-Hydroxy-2-methylquinoline|8-HYDROXY QUINALDINE|2-Methyl 8-quinolinol|2-Methyl-8-quinolinol|Hydroxyquinaldine|8-Hydroxyqinaldine|8-Hydroxyquinaldine|8-hydroxy-quinaldine|8-Quinolinol, 2-methyl-|2-Methyl-8-hydroxyquinoline|2-Methyl-quinolin-8-ol|2-Methylquinolin-8-ol|8-Hydroxyquinaldine (8-Hydroxy-2-methylquinoline)

Storage

Room temperature

Shipped In

Normal

개요

2-Methyl-8-quinolinol is a methyl substituted quinolinol derivative that shows fungicidal property.It can also undergo complexation with transition metal complexes.
2-Methyl-8-quinolinol (HqMe) may be used as a ligand for preparing bis (2-methyl-8-quinolinolato) aluminum(III)-μ-oxo-bis (2-methyl-8-quinolinolato ) aluminum (III). It may also be used in the preparation of a scandium 2-methyl-8-quinolinolate complex [Sc(qMe)4(H)].

사양

동의어

8-HYDROXY-2-METHYLQUINOLINE | HYDROXY-2-METHYLQUINOLINE, 8- | 2-Methyl-oxine | 8-Hydroxyquinaldine; 8-Hydroxy-2-methylquinoline | 8-HYDROXY QUINALDINE | 2-Methyl 8-quinolinol | 2-Methyl-8-quinolinol | Hydroxyquinaldine | 8-Hydroxyqinaldine | 8-Hydroxyquinaldine | 8-hydroxy-quinaldine | 8-Quinolinol, 2-methyl- | 2-Methyl-8-hydroxyquinoline Show more

사양 및 순도

≥98%

보관 조건

Room temperature

배송

Normal

순수함

≥98%

이름과 식별자

Pubchem Sid

488181817

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488181817

정식 스마일

CC1=NC2=C(C=CC=C2O)C=C1

IUPAC Name

2-methylquinolin-8-ol

InChIKey

NBYLBWHHTUWMER-UHFFFAOYSA-N

INCHI

1S/C10H9NO/c1-7-5-6-8-3-2-4-9(12)10(8)11-7/h2-6,12H,1H3

이성체 SMILES

CC1=NC2=C(C=CC=C2O)C=C1

WGK 독일

2

RTECS

VC7920000

UN 번호

3077

분자량

159.18

Beilstein

119194

Reaxy-Rn

119194

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=119194&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • 분류 Quinolines and derivatives
      • Subclass 8-hydroxyquinolines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• 분류: Quinolines and derivatives
• Subclass: 8-hydroxyquinolines
• Intermediate Tree Nodes: Not available
• Direct Parent: 8-hydroxyquinolines
• Alternative Parents: Methylpyridines 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: 8-hydroxyquinoline - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Methylpyridine - Benzenoid - Pyridine - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
• 설명: This compound belongs to the class of organic compounds known as 8-hydroxyquinolines. These are compounds containing a quinoline moiety, which carries a hydroxy group at the 8-position. Quinoline 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

관련 대상(인간)

ALOX5 Tclin Arachidonate 5-lipoxygenase (6568 Activities)

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TYR Tclin Tyrosinase (717 Activities)

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METAP1 Tchem Methionine aminopeptidase 1 (614 Activities)

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METAP2 Tchem Methionine aminopeptidase 2 (1512 Activities)

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MMP3 Tchem Matrix metalloproteinase 3 (3433 Activities)

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MMP8 Tchem Matrix metalloproteinase 8 (1942 Activities)

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MMP1 Tchem Matrix metalloproteinase-1 (7046 Activities)

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K562 (73714 Activities)

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MOLT-4 (49676 Activities)

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U-937 (7138 Activities)

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T47D (39041 Activities)

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HepG2 (196354 Activities)

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TDP1 Tchem Tyrosyl-DNA phosphodiesterase 1 (345557 Activities)

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SMAD3 Tchem Mothers against decapentaplegic homolog 3 (68039 Activities)

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관련 대상(비인간)

Nos2 Nitric oxide synthase, inducible (3573 Activities)

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Mmp2 Matrix metalloproteinase-2 (12 Activities)

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Mmp9 Matrix metalloproteinase 9 (38 Activities)

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pol Human immunodeficiency virus type 1 integrase (9041 Activities)

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Leishmania panamensis (230 Activities)

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Rattus norvegicus (775804 Activities)

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lef Anthrax lethal factor (7585 Activities)

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botA Botulinum neurotoxin type A (1303 Activities)

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Serum (58 Activities)

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작용 메커니즘

화학 및 물리적 특성

• 용해성: Insoluble in water;Solubility in Methanol almost transparency
• 발화점(°F): 282.2 °F
• 발화점(°C): 139℃
• 끓는점(°C): 267°C
• 녹는점(°C): 73°C
• 분자량: 159.180 g/mol
• XLogP3: 2.300
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 159.068 Da
• Monoisotopic Mass: 159.068 Da
• Topological Polar Surface Area: 33.100 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 160.000
• 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

자주 묻는 질문

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

How should this product be stored?

Store at room temperature.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 826-81-3, the molecular formula is C10H9NO, and the molecular weight is 159.18 g/mol. InChIKey NBYLBWHHTUWMER-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.