5-Hydroxyquinoline - ≥99% , CAS No.578-67-6

CAS: 578-67-6 Cat. No.: H120008 Formula: C₉H₇NO Molecular Weight: 145.16 Beilstein Registry Number: 114514 EC Number: 209-428-4

GRADE & PURITY ≥99%

Synonyms

A26231 | AC-5221 | 5Q0 | FT-0620497 | Q26841198 | L-Carnithine Tartrate | NSC 405729 | BDBM50182407 | dimethyl-sulfoxyde | Quinolin-5-ol | Q27098403 | NSC405729 | NSC-405729 | SB67580 | AO-801/41077389 | PJ4M78J3XW | BBL100329 | Ethanolamine, AR, 99% | 5-

Storage

Room temperature,Argon charged

Shipped In

Normal

Overview

5-Quinolinol (5-Hydroxyquinoline) was used as an internal standard in the reaction to measure morphine concentration in serum or plasma. It was also used as a lipophilic chelator and it decreased the rate of deoxygenation

Specifications

Synonyms

A26231 | AC-5221 | 5Q0 | FT-0620497 | Q26841198 | L-Carnithine Tartrate | NSC 405729 | BDBM50182407 | dimethyl-sulfoxyde | Quinolin-5-ol | Q27098403 | NSC405729 | NSC-405729 | SB67580 | AO-801/41077389 | PJ4M78J3XW | BBL100329 | Ethanolamine, AR, 99% | 5-

Specifications & Purity

≥99%

Storage

Room temperature,Argon charged

Shipped In

Normal

Purity

≥99%

Names and Identifiers

Pubchem Sid

488202900

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488202900

Canonical Smiles

C1=CC2=C(C=CC=N2)C(=C1)O

IUPAC Name

quinolin-5-ol

InChIKey

GYESAYHWISMZOK-UHFFFAOYSA-N

INCHI

1S/C9H7NO/c11-9-5-1-4-8-7(9)3-2-6-10-8/h1-6,11H

Isomeric SMILES

C1=CC2=C(C=CC=N2)C(=C1)O

WGK Germany

3

RTECS

VC4100000

Molecular Weight

145.16

Beilstein

114514

Reaxy-Rn

114514

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=114514&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Quinolines and derivatives
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Quinolines and derivatives
• Alternative Parents: 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Pyridines and derivatives Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Quinoline - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Benzenoid - Pyridine - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
• Description: 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: monohydroxyquinoline

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

Associated Targets(Human)

IDO1 Tchem Indoleamine 2,3-dioxygenase (6650 Activities)

Discover Target: IDO1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Skin (286 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Chemical and Physical Properties

• Sensitivity: light sensitive&air sensitive
• x_melt_point_char: 223-226°C
• Molecular Weight: 145.160 g/mol
• XLogP3: 2.300
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 145.053 Da
• Monoisotopic Mass: 145.053 Da
• Topological Polar Surface Area: 33.100 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 138.000
• 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

Frequently Asked Questions

What is the purity of this product?

This product is supplied at ≥99% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

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

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

The CAS Number is 578-67-6, the molecular formula is C9H7NO, and the molecular weight is 145.16 g/mol. InChIKey GYESAYHWISMZOK-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.