2-(3,5-difluorophenoxy)-1-(3-methoxyphenyl)ethanol

C15H14F2O3 — CID 62783956

IUPAC2-(3,5-difluorophenoxy)-1-(3-methoxyphenyl)ethanol
SMILESCOc1cccc(C(O)COc2cc(F)cc(F)c2)c1
InChIInChI=1S/C15H14F2O3/c1-19-13-4-2-3-10(5-13)15(18)9-20-14-7-11(16)6-12(17)8-14/h2-8,15,18H,9H2,1H3
InChIKeyFKUFISRIQSJSQP-UHFFFAOYSA-N
MW280.27 g/mol
LogP3.09
Rot. Bonds5

About 2-(3,5-difluorophenoxy)-1-(3-methoxyphenyl)ethanol

2-(3,5-difluorophenoxy)-1-(3-methoxyphenyl)ethanol (PubChem CID 62783956) has the molecular formula C15H14F2O3 and a molecular weight of 280.27 g/mol. Its IUPAC name is 2-(3,5-difluorophenoxy)-1-(3-methoxyphenyl)ethanol.

Molecular Properties

Compound Name2-(3,5-difluorophenoxy)-1-(3-methoxyphenyl)ethanol
PubChem CID62783956
Molecular FormulaC15H14F2O3
Molecular Weight280.27 g/mol
Exact Mass280.09
IUPAC Name2-(3,5-difluorophenoxy)-1-(3-methoxyphenyl)ethanol
SMILESCOc1cccc(C(O)COc2cc(F)cc(F)c2)c1
InChIInChI=1S/C15H14F2O3/c1-19-13-4-2-3-10(5-13)15(18)9-20-14-7-11(16)6-12(17)8-14/h2-8,15,18H,9H2,1H3
InChIKeyFKUFISRIQSJSQP-UHFFFAOYSA-N
XLogP3.09
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.27
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3,5-difluorophenoxy)-1-(4-methoxyphenyl)ethanol
CID 62783768
2-(4-bromo-3,5-dimethylphenoxy)-1-(3-methoxyphenyl)ethanol
CID 107725514
2-[3-(1-aminoethyl)phenoxy]-1-(3-methoxyphenyl)ethanol
CID 81134404
1-[4-[2-hydroxy-2-(3-methoxyphenyl)ethoxy]phenyl]ethanone
CID 81133388
2-[[6-(aminomethyl)-3-pyridinyl]oxy]-1-(3-methoxyphenyl)ethanol
CID 81134459
(4R)-4-hydroxy-4-(3-methoxyphenyl)butan-2-one
CID 101411477
2-[2-(hydroxymethyl)phenoxy]-1-(3-methoxyphenyl)ethanol
CID 81134038
1-(3-methoxyphenyl)-2-(2-propoxyphenoxy)ethanol
CID 110907759
2-(1-ethylpyrazol-4-yl)oxy-1-(3-methoxyphenyl)ethanol
CID 116802474
1-(3-methoxyphenyl)butan-1-ol
CID 2793894
[(2R)-2-hydroxy-2-(3-methoxyphenyl)ethyl] 2,2-dimethylpropanoate
CID 135065936
2-(2-bromo-4-chlorophenoxy)-1-(3-methoxyphenyl)ethanol
CID 112725152

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-difluorophenoxy)-1-(3-methoxyphenyl)ethanol?
The IUPAC name of 2-(3,5-difluorophenoxy)-1-(3-methoxyphenyl)ethanol (CID 62783956) is 2-(3,5-difluorophenoxy)-1-(3-methoxyphenyl)ethanol.
What is the SMILES notation for 2-(3,5-difluorophenoxy)-1-(3-methoxyphenyl)ethanol?
The canonical SMILES for 2-(3,5-difluorophenoxy)-1-(3-methoxyphenyl)ethanol is COc1cccc(C(O)COc2cc(F)cc(F)c2)c1.
What is the InChIKey of 2-(3,5-difluorophenoxy)-1-(3-methoxyphenyl)ethanol?
The InChIKey is FKUFISRIQSJSQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2O3/c1-19-13-4-2-3-10(5-13)15(18)9-20-14-7-11(16)6-12(17)8-14/h2-8,15,18H,9H2,1H3.
What are the key properties of 2-(3,5-difluorophenoxy)-1-(3-methoxyphenyl)ethanol?
2-(3,5-difluorophenoxy)-1-(3-methoxyphenyl)ethanol has a molecular weight of 280.27 g/mol, XLogP of 3.09, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-difluorophenoxy)-1-(3-methoxyphenyl)ethanol is sourced from PubChem (CID 62783956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).