1-(2-fluoro-6-hydroxyphenyl)ethanone

C8H7FO2 — CID 2737324

IUPAC1-(2-fluoro-6-hydroxyphenyl)ethanone
SMILESCC(=O)c1c(O)cccc1F
InChIInChI=1S/C8H7FO2/c1-5(10)8-6(9)3-2-4-7(8)11/h2-4,11H,1H3
InChIKeyPSNPXFMLAVLPPP-UHFFFAOYSA-N
MW154.14 g/mol
LogP1.73
Rot. Bonds1

About 1-(2-fluoro-6-hydroxyphenyl)ethanone

1-(2-fluoro-6-hydroxyphenyl)ethanone (PubChem CID 2737324) has the molecular formula C8H7FO2 and a molecular weight of 154.14 g/mol. Its IUPAC name is 1-(2-fluoro-6-hydroxyphenyl)ethanone.

Molecular Properties

Compound Name1-(2-fluoro-6-hydroxyphenyl)ethanone
PubChem CID2737324
Molecular FormulaC8H7FO2
Molecular Weight154.14 g/mol
Exact Mass154.04
IUPAC Name1-(2-fluoro-6-hydroxyphenyl)ethanone
SMILESCC(=O)c1c(O)cccc1F
InChIInChI=1S/C8H7FO2/c1-5(10)8-6(9)3-2-4-7(8)11/h2-4,11H,1H3
InChIKeyPSNPXFMLAVLPPP-UHFFFAOYSA-N
XLogP1.73
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.14
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2-fluoro-6-hydroxyphenyl)ethanone?
The IUPAC name of 1-(2-fluoro-6-hydroxyphenyl)ethanone (CID 2737324) is 1-(2-fluoro-6-hydroxyphenyl)ethanone.
What is the SMILES notation for 1-(2-fluoro-6-hydroxyphenyl)ethanone?
The canonical SMILES for 1-(2-fluoro-6-hydroxyphenyl)ethanone is CC(=O)c1c(O)cccc1F.
What is the InChIKey of 1-(2-fluoro-6-hydroxyphenyl)ethanone?
The InChIKey is PSNPXFMLAVLPPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7FO2/c1-5(10)8-6(9)3-2-4-7(8)11/h2-4,11H,1H3.
What are the key properties of 1-(2-fluoro-6-hydroxyphenyl)ethanone?
1-(2-fluoro-6-hydroxyphenyl)ethanone has a molecular weight of 154.14 g/mol, XLogP of 1.73, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluoro-6-hydroxyphenyl)ethanone is sourced from PubChem (CID 2737324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).