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6-Hydroxyquinoline-(1H)-2-one

CAT: 0572-TRC-H953250-250MGSize: 250 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-H953250-250MGSize:250 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
19315-93-6
Hazard Statement
Causes skin irritation
Purity
>95% (HPLC)
Smiles
Oc1ccc2nc(O)ccc2c1
Molecular Formula
C9 H7 N O2
Molecular Weight
161.16
InChI
InChI=1S/C9H7NO2/c11-7-2-3-8-6(5-7)1-4-9(12)10-8/h1-5,11H,(H,10,12)
Additionnal Information
IUPAC name: quinoline-2,6-diol
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

2,6-Dihydroxyquinoline

Quinoline-2,6-diol is a dihydroxyquinoline that is quinoline in which the hydrogens at positions 2 and 6 are replaced by hydroxy groups.

CAS Number19315-93-6
PubChem CID177065
IUPAC Name6-hydroxy-1H-quinolin-2-one
Molecular FormulaC9H7NO2
Molecular Weight161.16
XLogP0.9
Topological Polar Surface Area49.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count12
Formal Charge0
Complexity225
SMILES
C1=CC2=C(C=CC(=O)N2)C=C1O
InChI
InChI=1S/C9H7NO2/c11-7-2-3-8-6(5-7)1-4-9(12)10-8/h1-5,11H,(H,10,12)
InChIKey
AQLYZDRHNHZHIS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,6-Dihydroxyquinoline
CAS: 19315-93-6
CID: 177065
Formula: C9H7NO2
MW: 161.16
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight161.16
XLogP30.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass161.047678466
Monoisotopic Mass161.047678466
Topological Polar Surface Area49.3 Ų
Heavy Atom Count12
Formal Charge0
Complexity225
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes