9-hydroxycarbazole-2,7-diol

C12H9NO3 — CID 118518273

IUPAC9-hydroxycarbazole-2,7-diol
SMILESOc1ccc2c3ccc(O)cc3n(O)c2c1
InChIInChI=1S/C12H9NO3/c14-7-1-3-9-10-4-2-8(15)6-12(10)13(16)11(9)5-7/h1-6,14-16H
InChIKeyVWSZBDAFRGCQOS-UHFFFAOYSA-N
MW215.21 g/mol
LogP2.44
Rot. Bonds

About 9-hydroxycarbazole-2,7-diol

9-hydroxycarbazole-2,7-diol (PubChem CID 118518273) has the molecular formula C12H9NO3 and a molecular weight of 215.21 g/mol. Its IUPAC name is 9-hydroxycarbazole-2,7-diol.

Molecular Properties

Compound Name9-hydroxycarbazole-2,7-diol
PubChem CID118518273
Molecular FormulaC12H9NO3
Molecular Weight215.21 g/mol
Exact Mass215.06
IUPAC Name9-hydroxycarbazole-2,7-diol
SMILESOc1ccc2c3ccc(O)cc3n(O)c2c1
InChIInChI=1S/C12H9NO3/c14-7-1-3-9-10-4-2-8(15)6-12(10)13(16)11(9)5-7/h1-6,14-16H
InChIKeyVWSZBDAFRGCQOS-UHFFFAOYSA-N
XLogP2.44
TPSA65.62 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.21
LogP ≤ 52.44
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 9-hydroxycarbazole-2,7-diol?
The IUPAC name of 9-hydroxycarbazole-2,7-diol (CID 118518273) is 9-hydroxycarbazole-2,7-diol.
What is the SMILES notation for 9-hydroxycarbazole-2,7-diol?
The canonical SMILES for 9-hydroxycarbazole-2,7-diol is Oc1ccc2c3ccc(O)cc3n(O)c2c1.
What is the InChIKey of 9-hydroxycarbazole-2,7-diol?
The InChIKey is VWSZBDAFRGCQOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9NO3/c14-7-1-3-9-10-4-2-8(15)6-12(10)13(16)11(9)5-7/h1-6,14-16H.
What are the key properties of 9-hydroxycarbazole-2,7-diol?
9-hydroxycarbazole-2,7-diol has a molecular weight of 215.21 g/mol, XLogP of 2.44, 0 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-hydroxycarbazole-2,7-diol is sourced from PubChem (CID 118518273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).