1-(2-fluoro-4,6-dimethylphenyl)-1-(2-methoxyphenyl)ethanol

C17H19FO2 — CID 106880255

IUPAC1-(2-fluoro-4,6-dimethylphenyl)-1-(2-methoxyphenyl)ethanol
SMILESCOc1ccccc1C(C)(O)c1c(C)cc(C)cc1F
InChIInChI=1S/C17H19FO2/c1-11-9-12(2)16(14(18)10-11)17(3,19)13-7-5-6-8-15(13)20-4/h5-10,19H,1-4H3
InChIKeyNUQYTVCBHONNNA-UHFFFAOYSA-N
MW274.34 g/mol
LogP3.71
Rot. Bonds3

About 1-(2-fluoro-4,6-dimethylphenyl)-1-(2-methoxyphenyl)ethanol

1-(2-fluoro-4,6-dimethylphenyl)-1-(2-methoxyphenyl)ethanol (PubChem CID 106880255) has the molecular formula C17H19FO2 and a molecular weight of 274.34 g/mol. Its IUPAC name is 1-(2-fluoro-4,6-dimethylphenyl)-1-(2-methoxyphenyl)ethanol.

Molecular Properties

Compound Name1-(2-fluoro-4,6-dimethylphenyl)-1-(2-methoxyphenyl)ethanol
PubChem CID106880255
Molecular FormulaC17H19FO2
Molecular Weight274.34 g/mol
Exact Mass274.14
IUPAC Name1-(2-fluoro-4,6-dimethylphenyl)-1-(2-methoxyphenyl)ethanol
SMILESCOc1ccccc1C(C)(O)c1c(C)cc(C)cc1F
InChIInChI=1S/C17H19FO2/c1-11-9-12(2)16(14(18)10-11)17(3,19)13-7-5-6-8-15(13)20-4/h5-10,19H,1-4H3
InChIKeyNUQYTVCBHONNNA-UHFFFAOYSA-N
XLogP3.71
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.34
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,6-dimethoxyphenyl)-1-(2-methoxyphenyl)ethanol
CID 116809641
1-(5-fluoro-2-methoxyphenyl)-1-(2-methylphenyl)ethanol
CID 82770234
1-(4-fluorophenyl)-1-(2-methoxyphenyl)ethanol
CID 60793238
1-(5-bromo-2-fluorophenyl)-1-(2-methoxyphenyl)ethanol
CID 79743336
1-(5-fluoro-2-methoxyphenyl)-1-(2-fluorophenyl)ethanol
CID 82770802
1-(4-tert-butylphenyl)-1-(2-methoxyphenyl)ethanol
CID 62549935
1-(3,4-dimethoxyphenyl)-1-(2-methoxyphenyl)ethanol
CID 62788494
2-(2-methoxyphenyl)-3,3-dimethylbutan-2-ol
CID 591994
1-(5-chloro-2-methoxyphenyl)-1-(2-fluorophenyl)ethanol
CID 62788121
1-(2-methoxy-4,6-dimethylphenyl)-1-(3-methylphenyl)ethanol
CID 106679488
1-(2-fluoro-3-methoxyphenyl)-1-(3-methylphenyl)ethanol
CID 82806005
3-(2-methoxyphenyl)-2,2,4,4-tetramethylpentan-3-ol
CID 606344

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluoro-4,6-dimethylphenyl)-1-(2-methoxyphenyl)ethanol?
The IUPAC name of 1-(2-fluoro-4,6-dimethylphenyl)-1-(2-methoxyphenyl)ethanol (CID 106880255) is 1-(2-fluoro-4,6-dimethylphenyl)-1-(2-methoxyphenyl)ethanol.
What is the SMILES notation for 1-(2-fluoro-4,6-dimethylphenyl)-1-(2-methoxyphenyl)ethanol?
The canonical SMILES for 1-(2-fluoro-4,6-dimethylphenyl)-1-(2-methoxyphenyl)ethanol is COc1ccccc1C(C)(O)c1c(C)cc(C)cc1F.
What is the InChIKey of 1-(2-fluoro-4,6-dimethylphenyl)-1-(2-methoxyphenyl)ethanol?
The InChIKey is NUQYTVCBHONNNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FO2/c1-11-9-12(2)16(14(18)10-11)17(3,19)13-7-5-6-8-15(13)20-4/h5-10,19H,1-4H3.
What are the key properties of 1-(2-fluoro-4,6-dimethylphenyl)-1-(2-methoxyphenyl)ethanol?
1-(2-fluoro-4,6-dimethylphenyl)-1-(2-methoxyphenyl)ethanol has a molecular weight of 274.34 g/mol, XLogP of 3.71, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluoro-4,6-dimethylphenyl)-1-(2-methoxyphenyl)ethanol is sourced from PubChem (CID 106880255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).