2-fluoro-1-phenylethanol

C8H9FO — CID 9946

IUPAC2-fluoro-1-phenylethanol
SMILESOC(CF)c1ccccc1
InChIInChI=1S/C8H9FO/c9-6-8(10)7-4-2-1-3-5-7/h1-5,8,10H,6H2
InChIKeyFXOFPSAANUWIIM-UHFFFAOYSA-N
MW140.16 g/mol
LogP1.69
Rot. Bonds2

About 2-fluoro-1-phenylethanol

2-fluoro-1-phenylethanol (PubChem CID 9946) has the molecular formula C8H9FO and a molecular weight of 140.16 g/mol. Its IUPAC name is 2-fluoro-1-phenylethanol.

Molecular Properties

Compound Name2-fluoro-1-phenylethanol
PubChem CID9946
Molecular FormulaC8H9FO
Molecular Weight140.16 g/mol
Exact Mass140.06
IUPAC Name2-fluoro-1-phenylethanol
SMILESOC(CF)c1ccccc1
InChIInChI=1S/C8H9FO/c9-6-8(10)7-4-2-1-3-5-7/h1-5,8,10H,6H2
InChIKeyFXOFPSAANUWIIM-UHFFFAOYSA-N
XLogP1.69
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.16
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

Benzyl Alcohol
CID 244
2-Phenyl-2-propanol
CID 12053
2-Phenylethanol
CID 6054
1-Phenylethanol
CID 7409
Cuminol
CID 325
1-Phenyl-1-propanol
CID 7147
Fenipentol
CID 3338
4-Methylbenzyl alcohol
CID 11505
Benzenepropanol
CID 31234
Mandelonitrile
CID 10758
Benzhydrol
CID 7037
1-Phenyl-1,2-ethanediol
CID 7149

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-1-phenylethanol?
The IUPAC name of 2-fluoro-1-phenylethanol (CID 9946) is 2-fluoro-1-phenylethanol.
What is the SMILES notation for 2-fluoro-1-phenylethanol?
The canonical SMILES for 2-fluoro-1-phenylethanol is OC(CF)c1ccccc1.
What is the InChIKey of 2-fluoro-1-phenylethanol?
The InChIKey is FXOFPSAANUWIIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9FO/c9-6-8(10)7-4-2-1-3-5-7/h1-5,8,10H,6H2.
What are the key properties of 2-fluoro-1-phenylethanol?
2-fluoro-1-phenylethanol has a molecular weight of 140.16 g/mol, XLogP of 1.69, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-1-phenylethanol is sourced from PubChem (CID 9946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).