2-(4-aminophenyl)-6-fluorophenol

C12H10FNO — CID 171109419

IUPAC2-(4-aminophenyl)-6-fluorophenol
SMILESNc1ccc(-c2cccc(F)c2O)cc1
InChIInChI=1S/C12H10FNO/c13-11-3-1-2-10(12(11)15)8-4-6-9(14)7-5-8/h1-7,15H,14H2
InChIKeySOIXWQSJJAPYFX-UHFFFAOYSA-N
MW203.22 g/mol
LogP2.78
Rot. Bonds1

About 2-(4-aminophenyl)-6-fluorophenol

2-(4-aminophenyl)-6-fluorophenol (PubChem CID 171109419) has the molecular formula C12H10FNO and a molecular weight of 203.22 g/mol. Its IUPAC name is 2-(4-aminophenyl)-6-fluorophenol.

Molecular Properties

Compound Name2-(4-aminophenyl)-6-fluorophenol
PubChem CID171109419
Molecular FormulaC12H10FNO
Molecular Weight203.22 g/mol
Exact Mass203.07
IUPAC Name2-(4-aminophenyl)-6-fluorophenol
SMILESNc1ccc(-c2cccc(F)c2O)cc1
InChIInChI=1S/C12H10FNO/c13-11-3-1-2-10(12(11)15)8-4-6-9(14)7-5-8/h1-7,15H,14H2
InChIKeySOIXWQSJJAPYFX-UHFFFAOYSA-N
XLogP2.78
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.22
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(4-aminophenyl)-6-fluorophenol?
The IUPAC name of 2-(4-aminophenyl)-6-fluorophenol (CID 171109419) is 2-(4-aminophenyl)-6-fluorophenol.
What is the SMILES notation for 2-(4-aminophenyl)-6-fluorophenol?
The canonical SMILES for 2-(4-aminophenyl)-6-fluorophenol is Nc1ccc(-c2cccc(F)c2O)cc1.
What is the InChIKey of 2-(4-aminophenyl)-6-fluorophenol?
The InChIKey is SOIXWQSJJAPYFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10FNO/c13-11-3-1-2-10(12(11)15)8-4-6-9(14)7-5-8/h1-7,15H,14H2.
What are the key properties of 2-(4-aminophenyl)-6-fluorophenol?
2-(4-aminophenyl)-6-fluorophenol has a molecular weight of 203.22 g/mol, XLogP of 2.78, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminophenyl)-6-fluorophenol is sourced from PubChem (CID 171109419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).