2-(3-fluorophenyl)ethanol

C8H9FO — CID 573132

IUPAC2-(3-fluorophenyl)ethanol
SMILESOCCc1cccc(F)c1
InChIInChI=1S/C8H9FO/c9-8-3-1-2-7(6-8)4-5-10/h1-3,6,10H,4-5H2
InChIKeyMZNBGEKFZCWVES-UHFFFAOYSA-N
MW140.16 g/mol
LogP1.36
Rot. Bonds2

About 2-(3-fluorophenyl)ethanol

2-(3-fluorophenyl)ethanol (PubChem CID 573132) has the molecular formula C8H9FO and a molecular weight of 140.16 g/mol. Its IUPAC name is 2-(3-fluorophenyl)ethanol.

Molecular Properties

Compound Name2-(3-fluorophenyl)ethanol
PubChem CID573132
Molecular FormulaC8H9FO
Molecular Weight140.16 g/mol
Exact Mass140.06
IUPAC Name2-(3-fluorophenyl)ethanol
SMILESOCCc1cccc(F)c1
InChIInChI=1S/C8H9FO/c9-8-3-1-2-7(6-8)4-5-10/h1-3,6,10H,4-5H2
InChIKeyMZNBGEKFZCWVES-UHFFFAOYSA-N
XLogP1.36
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 ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)ethanol?
The IUPAC name of 2-(3-fluorophenyl)ethanol (CID 573132) is 2-(3-fluorophenyl)ethanol.
What is the SMILES notation for 2-(3-fluorophenyl)ethanol?
The canonical SMILES for 2-(3-fluorophenyl)ethanol is OCCc1cccc(F)c1.
What is the InChIKey of 2-(3-fluorophenyl)ethanol?
The InChIKey is MZNBGEKFZCWVES-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9FO/c9-8-3-1-2-7(6-8)4-5-10/h1-3,6,10H,4-5H2.
What are the key properties of 2-(3-fluorophenyl)ethanol?
2-(3-fluorophenyl)ethanol has a molecular weight of 140.16 g/mol, XLogP of 1.36, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)ethanol is sourced from PubChem (CID 573132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).