8-hydroxyquinoline-2-carbaldehyde

C10H7NO2 — CID 599342

IUPAC8-hydroxyquinoline-2-carbaldehyde
SMILESO=Cc1ccc2cccc(O)c2n1
InChIInChI=1S/C10H7NO2/c12-6-8-5-4-7-2-1-3-9(13)10(7)11-8/h1-6,13H
InChIKeySLBPIHCMXPQAIQ-UHFFFAOYSA-N
MW173.17 g/mol
LogP1.75
Rot. Bonds1

About 8-hydroxyquinoline-2-carbaldehyde

8-hydroxyquinoline-2-carbaldehyde (PubChem CID 599342) has the molecular formula C10H7NO2 and a molecular weight of 173.17 g/mol. Its IUPAC name is 8-hydroxyquinoline-2-carbaldehyde.

Molecular Properties

Compound Name8-hydroxyquinoline-2-carbaldehyde
PubChem CID599342
Molecular FormulaC10H7NO2
Molecular Weight173.17 g/mol
Exact Mass173.05
IUPAC Name8-hydroxyquinoline-2-carbaldehyde
SMILESO=Cc1ccc2cccc(O)c2n1
InChIInChI=1S/C10H7NO2/c12-6-8-5-4-7-2-1-3-9(13)10(7)11-8/h1-6,13H
InChIKeySLBPIHCMXPQAIQ-UHFFFAOYSA-N
XLogP1.75
TPSA50.19 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.17
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 8-hydroxyquinoline-2-carbaldehyde?
The IUPAC name of 8-hydroxyquinoline-2-carbaldehyde (CID 599342) is 8-hydroxyquinoline-2-carbaldehyde.
What is the SMILES notation for 8-hydroxyquinoline-2-carbaldehyde?
The canonical SMILES for 8-hydroxyquinoline-2-carbaldehyde is O=Cc1ccc2cccc(O)c2n1.
What is the InChIKey of 8-hydroxyquinoline-2-carbaldehyde?
The InChIKey is SLBPIHCMXPQAIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7NO2/c12-6-8-5-4-7-2-1-3-9(13)10(7)11-8/h1-6,13H.
What are the key properties of 8-hydroxyquinoline-2-carbaldehyde?
8-hydroxyquinoline-2-carbaldehyde has a molecular weight of 173.17 g/mol, XLogP of 1.75, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-hydroxyquinoline-2-carbaldehyde is sourced from PubChem (CID 599342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).