1-hydroxy-9H-carbazole-3-carbaldehyde

C13H9NO2 — CID 611174

IUPAC1-hydroxy-9H-carbazole-3-carbaldehyde
SMILESO=Cc1cc(O)c2[nH]c3ccccc3c2c1
InChIInChI=1S/C13H9NO2/c15-7-8-5-10-9-3-1-2-4-11(9)14-13(10)12(16)6-8/h1-7,14,16H
InChIKeyOYSFFQUIYNEZKX-UHFFFAOYSA-N
MW211.22 g/mol
LogP2.84
Rot. Bonds1

About 1-hydroxy-9H-carbazole-3-carbaldehyde

1-hydroxy-9H-carbazole-3-carbaldehyde (PubChem CID 611174) has the molecular formula C13H9NO2 and a molecular weight of 211.22 g/mol. Its IUPAC name is 1-hydroxy-9H-carbazole-3-carbaldehyde.

Molecular Properties

Compound Name1-hydroxy-9H-carbazole-3-carbaldehyde
PubChem CID611174
Molecular FormulaC13H9NO2
Molecular Weight211.22 g/mol
Exact Mass211.06
IUPAC Name1-hydroxy-9H-carbazole-3-carbaldehyde
SMILESO=Cc1cc(O)c2[nH]c3ccccc3c2c1
InChIInChI=1S/C13H9NO2/c15-7-8-5-10-9-3-1-2-4-11(9)14-13(10)12(16)6-8/h1-7,14,16H
InChIKeyOYSFFQUIYNEZKX-UHFFFAOYSA-N
XLogP2.84
TPSA53.09 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.22
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-9H-carbazole-3-carbaldehyde?
The IUPAC name of 1-hydroxy-9H-carbazole-3-carbaldehyde (CID 611174) is 1-hydroxy-9H-carbazole-3-carbaldehyde.
What is the SMILES notation for 1-hydroxy-9H-carbazole-3-carbaldehyde?
The canonical SMILES for 1-hydroxy-9H-carbazole-3-carbaldehyde is O=Cc1cc(O)c2[nH]c3ccccc3c2c1.
What is the InChIKey of 1-hydroxy-9H-carbazole-3-carbaldehyde?
The InChIKey is OYSFFQUIYNEZKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9NO2/c15-7-8-5-10-9-3-1-2-4-11(9)14-13(10)12(16)6-8/h1-7,14,16H.
What are the key properties of 1-hydroxy-9H-carbazole-3-carbaldehyde?
1-hydroxy-9H-carbazole-3-carbaldehyde has a molecular weight of 211.22 g/mol, XLogP of 2.84, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-9H-carbazole-3-carbaldehyde is sourced from PubChem (CID 611174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).