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

C9H11FO2 — CID 26597266

IUPAC(1R)-1-(5-fluoro-2-methoxyphenyl)ethanol
SMILESCOc1ccc(F)cc1[C@@H](C)O
InChIInChI=1S/C9H11FO2/c1-6(11)8-5-7(10)3-4-9(8)12-2/h3-6,11H,1-2H3/t6-/m1/s1
InChIKeyVLBOHPCLXJIASU-ZCFIWIBFSA-N
MW170.18 g/mol
LogP1.89
Rot. Bonds2

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

(1R)-1-(5-fluoro-2-methoxyphenyl)ethanol (PubChem CID 26597266) has the molecular formula C9H11FO2 and a molecular weight of 170.18 g/mol. Its IUPAC name is (1R)-1-(5-fluoro-2-methoxyphenyl)ethanol.

Molecular Properties

Compound Name(1R)-1-(5-fluoro-2-methoxyphenyl)ethanol
PubChem CID26597266
Molecular FormulaC9H11FO2
Molecular Weight170.18 g/mol
Exact Mass170.07
IUPAC Name(1R)-1-(5-fluoro-2-methoxyphenyl)ethanol
SMILESCOc1ccc(F)cc1[C@@H](C)O
InChIInChI=1S/C9H11FO2/c1-6(11)8-5-7(10)3-4-9(8)12-2/h3-6,11H,1-2H3/t6-/m1/s1
InChIKeyVLBOHPCLXJIASU-ZCFIWIBFSA-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

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Frequently Asked Questions

What is the IUPAC name of (1R)-1-(5-fluoro-2-methoxyphenyl)ethanol?
The IUPAC name of (1R)-1-(5-fluoro-2-methoxyphenyl)ethanol (CID 26597266) is (1R)-1-(5-fluoro-2-methoxyphenyl)ethanol.
What is the SMILES notation for (1R)-1-(5-fluoro-2-methoxyphenyl)ethanol?
The canonical SMILES for (1R)-1-(5-fluoro-2-methoxyphenyl)ethanol is COc1ccc(F)cc1[C@@H](C)O.
What is the InChIKey of (1R)-1-(5-fluoro-2-methoxyphenyl)ethanol?
The InChIKey is VLBOHPCLXJIASU-ZCFIWIBFSA-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/t6-/m1/s1.
What are the key properties of (1R)-1-(5-fluoro-2-methoxyphenyl)ethanol?
(1R)-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 (1R)-1-(5-fluoro-2-methoxyphenyl)ethanol is sourced from PubChem (CID 26597266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).