7-nitro-9H-fluoren-2-ol

C13H9NO3 — CID 23119

IUPAC7-nitro-9H-fluoren-2-ol
SMILESO=[N+]([O-])c1ccc2c(c1)Cc1cc(O)ccc1-2
InChIInChI=1S/C13H9NO3/c15-11-2-4-13-9(7-11)5-8-6-10(14(16)17)1-3-12(8)13/h1-4,6-7,15H,5H2
InChIKeyVFTOHJFKIJLYKN-UHFFFAOYSA-N
MW227.22 g/mol
LogP2.87
Rot. Bonds1

About 7-nitro-9H-fluoren-2-ol

7-nitro-9H-fluoren-2-ol (PubChem CID 23119) has the molecular formula C13H9NO3 and a molecular weight of 227.22 g/mol. Its IUPAC name is 7-nitro-9H-fluoren-2-ol.

Molecular Properties

Compound Name7-nitro-9H-fluoren-2-ol
PubChem CID23119
Molecular FormulaC13H9NO3
Molecular Weight227.22 g/mol
Exact Mass227.06
IUPAC Name7-nitro-9H-fluoren-2-ol
SMILESO=[N+]([O-])c1ccc2c(c1)Cc1cc(O)ccc1-2
InChIInChI=1S/C13H9NO3/c15-11-2-4-13-9(7-11)5-8-6-10(14(16)17)1-3-12(8)13/h1-4,6-7,15H,5H2
InChIKeyVFTOHJFKIJLYKN-UHFFFAOYSA-N
XLogP2.87
TPSA63.37 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.22
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 7-nitro-9H-fluoren-2-ol?
The IUPAC name of 7-nitro-9H-fluoren-2-ol (CID 23119) is 7-nitro-9H-fluoren-2-ol.
What is the SMILES notation for 7-nitro-9H-fluoren-2-ol?
The canonical SMILES for 7-nitro-9H-fluoren-2-ol is O=[N+]([O-])c1ccc2c(c1)Cc1cc(O)ccc1-2.
What is the InChIKey of 7-nitro-9H-fluoren-2-ol?
The InChIKey is VFTOHJFKIJLYKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9NO3/c15-11-2-4-13-9(7-11)5-8-6-10(14(16)17)1-3-12(8)13/h1-4,6-7,15H,5H2.
What are the key properties of 7-nitro-9H-fluoren-2-ol?
7-nitro-9H-fluoren-2-ol has a molecular weight of 227.22 g/mol, XLogP of 2.87, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-nitro-9H-fluoren-2-ol is sourced from PubChem (CID 23119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).