1-(4-ethoxyphenyl)-2-(4-fluoro-2-methylphenyl)ethanol

C17H19FO2 — CID 114346759

IUPAC1-(4-ethoxyphenyl)-2-(4-fluoro-2-methylphenyl)ethanol
SMILESCCOc1ccc(C(O)Cc2ccc(F)cc2C)cc1
InChIInChI=1S/C17H19FO2/c1-3-20-16-8-5-13(6-9-16)17(19)11-14-4-7-15(18)10-12(14)2/h4-10,17,19H,3,11H2,1-2H3
InChIKeyIGDMPTMDRRDQLN-UHFFFAOYSA-N
MW274.34 g/mol
LogP3.81
Rot. Bonds5

About 1-(4-ethoxyphenyl)-2-(4-fluoro-2-methylphenyl)ethanol

1-(4-ethoxyphenyl)-2-(4-fluoro-2-methylphenyl)ethanol (PubChem CID 114346759) has the molecular formula C17H19FO2 and a molecular weight of 274.34 g/mol. Its IUPAC name is 1-(4-ethoxyphenyl)-2-(4-fluoro-2-methylphenyl)ethanol.

Molecular Properties

Compound Name1-(4-ethoxyphenyl)-2-(4-fluoro-2-methylphenyl)ethanol
PubChem CID114346759
Molecular FormulaC17H19FO2
Molecular Weight274.34 g/mol
Exact Mass274.14
IUPAC Name1-(4-ethoxyphenyl)-2-(4-fluoro-2-methylphenyl)ethanol
SMILESCCOc1ccc(C(O)Cc2ccc(F)cc2C)cc1
InChIInChI=1S/C17H19FO2/c1-3-20-16-8-5-13(6-9-16)17(19)11-14-4-7-15(18)10-12(14)2/h4-10,17,19H,3,11H2,1-2H3
InChIKeyIGDMPTMDRRDQLN-UHFFFAOYSA-N
XLogP3.81
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.34
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-ethoxyphenyl)-2-(4-fluoro-2-methylphenyl)ethanol
CID 114346766
2-(2-bromo-5-fluorophenyl)-1-(4-ethoxyphenyl)ethanol
CID 65146117
2-(4-fluoro-2-methylphenyl)-1-(4-iodophenyl)ethanol
CID 115838318
1-(4-ethoxyphenyl)-2-(3-fluorophenyl)ethanol
CID 61099189
(1R)-1-[4-[(4-fluoro-2-methylphenyl)methoxy]phenyl]ethanol
CID 104894080
1-(3-bromo-4-fluorophenyl)-2-(4-fluoro-2-methylphenyl)ethanol
CID 114346820
1-(4-butoxyphenyl)-2-(4-fluorophenyl)ethanol
CID 63017882
2-(4-fluoro-2-methylphenyl)-1-(2-methoxyphenyl)ethanol
CID 114346762
2-[chloro-(4-ethoxyphenyl)methyl]-4-fluoro-1-methylbenzene
CID 63429360
2-(5-fluoro-2-methylphenyl)-1-(4-propan-2-ylphenyl)ethanol
CID 105372798
ethyl 3-(4-fluoro-2-methylphenyl)-2-hydroxypropanoate
CID 114346916
(1R)-1-[4-[(4-fluoro-2-methylphenyl)methoxy]phenyl]ethanamine
CID 104894045

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethoxyphenyl)-2-(4-fluoro-2-methylphenyl)ethanol?
The IUPAC name of 1-(4-ethoxyphenyl)-2-(4-fluoro-2-methylphenyl)ethanol (CID 114346759) is 1-(4-ethoxyphenyl)-2-(4-fluoro-2-methylphenyl)ethanol.
What is the SMILES notation for 1-(4-ethoxyphenyl)-2-(4-fluoro-2-methylphenyl)ethanol?
The canonical SMILES for 1-(4-ethoxyphenyl)-2-(4-fluoro-2-methylphenyl)ethanol is CCOc1ccc(C(O)Cc2ccc(F)cc2C)cc1.
What is the InChIKey of 1-(4-ethoxyphenyl)-2-(4-fluoro-2-methylphenyl)ethanol?
The InChIKey is IGDMPTMDRRDQLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FO2/c1-3-20-16-8-5-13(6-9-16)17(19)11-14-4-7-15(18)10-12(14)2/h4-10,17,19H,3,11H2,1-2H3.
What are the key properties of 1-(4-ethoxyphenyl)-2-(4-fluoro-2-methylphenyl)ethanol?
1-(4-ethoxyphenyl)-2-(4-fluoro-2-methylphenyl)ethanol has a molecular weight of 274.34 g/mol, XLogP of 3.81, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethoxyphenyl)-2-(4-fluoro-2-methylphenyl)ethanol is sourced from PubChem (CID 114346759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).