2-(2-chloro-6-fluorophenyl)ethanol

C8H8ClFO — CID 2733235

IUPAC2-(2-chloro-6-fluorophenyl)ethanol
SMILESOCCc1c(F)cccc1Cl
InChIInChI=1S/C8H8ClFO/c9-7-2-1-3-8(10)6(7)4-5-11/h1-3,11H,4-5H2
InChIKeyUYZAUXBNFFFZFA-UHFFFAOYSA-N
MW174.60 g/mol
LogP2.01
Rot. Bonds2

About 2-(2-chloro-6-fluorophenyl)ethanol

2-(2-chloro-6-fluorophenyl)ethanol (PubChem CID 2733235) has the molecular formula C8H8ClFO and a molecular weight of 174.60 g/mol. Its IUPAC name is 2-(2-chloro-6-fluorophenyl)ethanol.

Molecular Properties

Compound Name2-(2-chloro-6-fluorophenyl)ethanol
PubChem CID2733235
Molecular FormulaC8H8ClFO
Molecular Weight174.60 g/mol
Exact Mass174.02
IUPAC Name2-(2-chloro-6-fluorophenyl)ethanol
SMILESOCCc1c(F)cccc1Cl
InChIInChI=1S/C8H8ClFO/c9-7-2-1-3-8(10)6(7)4-5-11/h1-3,11H,4-5H2
InChIKeyUYZAUXBNFFFZFA-UHFFFAOYSA-N
XLogP2.01
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.60
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-6-fluorophenyl)ethanol?
The IUPAC name of 2-(2-chloro-6-fluorophenyl)ethanol (CID 2733235) is 2-(2-chloro-6-fluorophenyl)ethanol.
What is the SMILES notation for 2-(2-chloro-6-fluorophenyl)ethanol?
The canonical SMILES for 2-(2-chloro-6-fluorophenyl)ethanol is OCCc1c(F)cccc1Cl.
What is the InChIKey of 2-(2-chloro-6-fluorophenyl)ethanol?
The InChIKey is UYZAUXBNFFFZFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8ClFO/c9-7-2-1-3-8(10)6(7)4-5-11/h1-3,11H,4-5H2.
What are the key properties of 2-(2-chloro-6-fluorophenyl)ethanol?
2-(2-chloro-6-fluorophenyl)ethanol has a molecular weight of 174.60 g/mol, XLogP of 2.01, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-6-fluorophenyl)ethanol is sourced from PubChem (CID 2733235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).