6-Hydroxyquinoline
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Basic information
- CAS
580-16-5- Standard SMILES
Oc1ccc2ncccc2c1- InChIKey
OVYWMEWYEJLIER-UHFFFAOYSA-N- Molecular formula
- C9H7NO
- Average molar mass
- 145.16 g/mol
- Monoisotopic mass
- 145.05276384
Overview
Quinolin-6-ol is a monohydroxyquinoline that is quinoline substituted by a hydroxy group at position 6.
Names & identifiers
- Preferred name
- 6-Hydroxyquinoline
- IUPAC
- quinolin-6-ol
- English name
- 6-Quinolinol
- Molecular formula
- C9H7NO
- Molecular weight
- 145.16
Names & synonyms
6-Hydroxyquinoline580-16-5Quinolin-6-ol6-QUINOLINOL1H-1,6-Epoxyquinoline95RU6I7UXLCCRIS-4331DTXSID40206726NSC-26343CHEBI:48994RefChem:178237DTXCID70129217
Show more names
6-QuinoLAKOS 222-066-Quinolinol >TIMTEC-BB SBB0041176-HYDROXYQUINOLINE 98%6-Hydroxyquinoline,98%
209-454-66-ChinolinolCCRIS 4331MFCD00047611NSC 26343BRN 0113196OVYWMEWYEJLIER-UHFFFAOYSA-AC-907/25014237
Database identifiers
- CAS
580-16-5- PubChem CID
- 11374
- DTXSID
DTXSID40206726- ChEMBL
CHEMBL1908053- ChEBI
CHEBI:48994- UNII
- 95RU6I7UXL
- EC Number
- 209-454-6
- Nikkaji
- J46.496A
Properties
Computed structural propertiesFilling in
- XLogP
- 1.8
- Topological polar surface area
- 33.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 138
Experimental & physicochemical properties
SpringerMaterials PropertiesDiamagnetic susceptibility
LogP1.8
Physicochemical properties
- Melting point
- 188 · 188-190 °C (lit.)
- Boiling point
- 264.27 °C · 264.27°C (rough estimate)
- Density
- 1.1555 · 1.1555 (rough estimate)
- refractive index
- 1.45 · 1.4500 (estimate)
- storage temp.
- Keep in dark place,Inert atmosphere,Room temperature
- solubility
- DMSO (Slightly), Methanol (Slightly)
- form
- Powder
- pka
- 5.15 · 5.15, 8.90(at 20℃)
- color
- Beige to gray or brown
- Water Solubility
- almost insoluble
- BRN
- 113196 · 113196
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- F
- 8
- PPE
- dust mask type N95 (US), Eyeshields, Gloves
- wgk
- 3
- rtecs
- VC4130000
- hs_code
- 29334900
- risk_code
- 36/37/38-20/21/22
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi,Xn
- safety_code
- 26-36-37/39
- Storage Class
- 11 - Combustible Solids
- target organs
- Respiratory system
- Hazard statements
- H315-H319-H335
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
- Precautionary statements
Chemistry & industry
Applications
Uses6-Hydroxyquinoline was used in synthesis of 2,6-substituted-benzo[d]thiazole analogs and 2,4-substituted-benzo[d]thiazole analogs.
General Description6-Hydroxyquinoline is an ideal photoacid system for exploring excited-state proton transfer (ESPT) reactions. The excited-state proton transfer and geminate recombination of 6-hydroxyquinoline encaged in catalytic Na+-exchanged faujasite zeolites X and Y have been explored by measuring steady-state and picosecond time-resolved spectra.
Upstream & downstream products
Upstream raw materials
Related reactions
115 records
Compound notes
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