1-(5-fluoro-2-methoxyphenyl)ethanol

C9H11FO2 — CID 44891074

IUPAC1-(5-fluoro-2-methoxyphenyl)ethanol
SMILESCOc1ccc(F)cc1C(C)O
InChIInChI=1S/C9H11FO2/c1-6(11)8-5-7(10)3-4-9(8)12-2/h3-6,11H,1-2H3
InChIKeyVLBOHPCLXJIASU-UHFFFAOYSA-N
MW170.18 g/mol
LogP1.89
Rot. Bonds2

About 1-(5-fluoro-2-methoxyphenyl)ethanol

1-(5-fluoro-2-methoxyphenyl)ethanol (PubChem CID 44891074) has the molecular formula C9H11FO2 and a molecular weight of 170.18 g/mol. Its IUPAC name is 1-(5-fluoro-2-methoxyphenyl)ethanol.

Molecular Properties

Compound Name1-(5-fluoro-2-methoxyphenyl)ethanol
PubChem CID44891074
Molecular FormulaC9H11FO2
Molecular Weight170.18 g/mol
Exact Mass170.07
IUPAC Name1-(5-fluoro-2-methoxyphenyl)ethanol
SMILESCOc1ccc(F)cc1C(C)O
InChIInChI=1S/C9H11FO2/c1-6(11)8-5-7(10)3-4-9(8)12-2/h3-6,11H,1-2H3
InChIKeyVLBOHPCLXJIASU-UHFFFAOYSA-N
XLogP1.89
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.18
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(5-fluoro-2-methoxyphenyl)ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoro-2-methoxyphenyl)ethanol?
The IUPAC name of 1-(5-fluoro-2-methoxyphenyl)ethanol (CID 44891074) is 1-(5-fluoro-2-methoxyphenyl)ethanol.
What is the SMILES notation for 1-(5-fluoro-2-methoxyphenyl)ethanol?
The canonical SMILES for 1-(5-fluoro-2-methoxyphenyl)ethanol is COc1ccc(F)cc1C(C)O.
What is the InChIKey of 1-(5-fluoro-2-methoxyphenyl)ethanol?
The InChIKey is VLBOHPCLXJIASU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11FO2/c1-6(11)8-5-7(10)3-4-9(8)12-2/h3-6,11H,1-2H3.
What are the key properties of 1-(5-fluoro-2-methoxyphenyl)ethanol?
1-(5-fluoro-2-methoxyphenyl)ethanol has a molecular weight of 170.18 g/mol, XLogP of 1.89, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-fluoro-2-methoxyphenyl)ethanol is sourced from PubChem (CID 44891074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).