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Basic Description
| Synonyms | 4053-45-6 | 5-(CHLOROMETHYL)-8-QUINOLINOL HYDROCHLORIDE | 5-(chloromethyl)quinolin-8-ol hydrochloride | 5-(chloromethyl)quinolin-8-ol;hydrochloride | 5-(chloromethyl)-8-quinolinol hcl | 5-(chloromethyl)quinolin-8-ol hcl | MFCD01790514 | 5-(CHLOROMETHYL)-8-QUINOLINOL, H |
|---|---|
| Specifications & Purity | ≥95% |
| Shipped In | Normal |
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Quinolines and derivatives
- Subclass 8-hydroxyquinolines
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Class
Quinolines and derivatives
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Superclass
Organoheterocyclic compounds
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organoheterocyclic compounds |
| Class | Quinolines and derivatives |
| Subclass | 8-hydroxyquinolines |
| Intermediate Tree Nodes | Not available |
| Direct Parent | 8-hydroxyquinolines |
| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids Pyridines and derivatives Heteroaromatic compounds Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organochlorides Hydrochlorides Hydrocarbon derivatives Alkyl chlorides |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | 8-hydroxyquinoline - Phenol - 1-hydroxy-2-unsubstituted benzenoid - Pyridine - Benzenoid - Heteroaromatic compound - Azacycle - Alkyl chloride - Hydrochloride - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Alkyl halide - Aromatic heteropolycyclic compound |
| Description | 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 |
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Associated Targets(non-human)
Pseudomonas aeruginosa (123386 Activities)
| Activity Type | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
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Klebsiella pneumoniae (43867 Activities)
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Staphylococcus aureus (210822 Activities)
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Acinetobacter baumannii (41033 Activities)
| Activity Type | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
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Escherichia coli (133304 Activities)
| Activity Type | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
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Cryptococcus neoformans (21258 Activities)
| Activity Type | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
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Candida albicans (78123 Activities)
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Mechanisms of Action
| Mechanism of Action | Action Type | target ID | Target Name | Target Type | Target Organism | Binding Site Name | References |
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Names and Identifiers
| IUPAC Name | 5-(chloromethyl)quinolin-8-ol;hydrochloride |
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| INCHI | InChI=1S/C10H8ClNO.ClH/c11-6-7-3-4-9(13)10-8(7)2-1-5-12-10;/h1-5,13H,6H2;1H |
| InChIKey | BDQGTRWOFVSOQX-UHFFFAOYSA-N |
| Smiles | C1=CC2=C(C=CC(=C2N=C1)O)CCl.Cl |
| Isomeric SMILES | C1=CC2=C(C=CC(=C2N=C1)O)CCl.Cl |
| PubChem CID | 12269596 |
| Molecular Weight | 230.09 |
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
 F2429215 |
Certificate of Analysis | Jun 03, 2024 | C193265 |
| F2429217 |
Certificate of Analysis | Jun 03, 2024 | C193265 |
| F2429227 |
Certificate of Analysis | Jun 03, 2024 | C193265 |
| F2429236 |
Certificate of Analysis | Jun 03, 2024 | C193265 |
| F2429211 |
Certificate of Analysis | Jun 03, 2024 | C193265 |
| F2429213 |
Certificate of Analysis | Jun 03, 2024 | C193265 |
Chemical and Physical Properties
| Molecular Weight | 230.090 g/mol |
|---|---|
| XLogP3 | |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 1 |
| Exact Mass | 229.006 Da |
| Monoisotopic Mass | 229.006 Da |
| Topological Polar Surface Area | 33.100 Ų |
| Heavy Atom Count | 14 |
| Formal Charge | 0 |
| Complexity | 176.000 |
| 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 | 2 |
Alternative Products
-
8-(Bromomethyl)quinolineStarting at $9.90
-
5-Chloro-8-quinolinol
Starting at $11.90
-
5-(morpholin-4-ylmethyl)quinolin-8-ol
Starting at $153.90
-
5-Amino-8-hydroxyquinoline Dihydrochloride
Starting at $9.90
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