1-(3-fluoro-4-methoxyphenyl)-2-(3-fluorophenyl)ethanol

C15H14F2O2 — CID 61082269

IUPAC1-(3-fluoro-4-methoxyphenyl)-2-(3-fluorophenyl)ethanol
SMILESCOc1ccc(C(O)Cc2cccc(F)c2)cc1F
InChIInChI=1S/C15H14F2O2/c1-19-15-6-5-11(9-13(15)17)14(18)8-10-3-2-4-12(16)7-10/h2-7,9,14,18H,8H2,1H3
InChIKeyNJNFEGBGTIOROJ-UHFFFAOYSA-N
MW264.27 g/mol
LogP3.25
Rot. Bonds4

About 1-(3-fluoro-4-methoxyphenyl)-2-(3-fluorophenyl)ethanol

1-(3-fluoro-4-methoxyphenyl)-2-(3-fluorophenyl)ethanol (PubChem CID 61082269) has the molecular formula C15H14F2O2 and a molecular weight of 264.27 g/mol. Its IUPAC name is 1-(3-fluoro-4-methoxyphenyl)-2-(3-fluorophenyl)ethanol.

Molecular Properties

Compound Name1-(3-fluoro-4-methoxyphenyl)-2-(3-fluorophenyl)ethanol
PubChem CID61082269
Molecular FormulaC15H14F2O2
Molecular Weight264.27 g/mol
Exact Mass264.10
IUPAC Name1-(3-fluoro-4-methoxyphenyl)-2-(3-fluorophenyl)ethanol
SMILESCOc1ccc(C(O)Cc2cccc(F)c2)cc1F
InChIInChI=1S/C15H14F2O2/c1-19-15-6-5-11(9-13(15)17)14(18)8-10-3-2-4-12(16)7-10/h2-7,9,14,18H,8H2,1H3
InChIKeyNJNFEGBGTIOROJ-UHFFFAOYSA-N
XLogP3.25
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.27
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-fluoro-4-methoxyphenyl)-3-(3-fluorophenyl)propan-2-ol
CID 62608783
2-(3-fluoro-4-methoxyphenyl)-3-(3-fluorophenyl)propan-1-amine
CID 83973647
2-(3-bromo-5-fluorophenyl)-1-(3-fluoro-4-methoxyphenyl)ethanol
CID 79702145
1-(3,5-dimethoxyphenyl)-2-(3-fluorophenyl)ethanol
CID 63016216
2-(2,3-dihydro-1H-inden-5-yl)-1-(3-fluoro-4-methoxyphenyl)ethanol
CID 65101112
2-(2-chloro-4-fluorophenyl)-1-(3-fluoro-4-methoxyphenyl)ethanol
CID 63035615
2-(3-fluoro-4-methoxyphenyl)-1-(4-methoxyphenyl)ethanol
CID 62622685
2-(2,3-dichlorophenyl)-1-(3-fluoro-4-methoxyphenyl)ethanol
CID 107307527
2-amino-1-(3-fluoro-4-methoxyphenyl)ethanol
CID 13079645
(1R)-2-bromo-1-(3-fluoro-4-methoxyphenyl)ethanol
CID 83000611
1-(3-fluoro-4-methoxyphenyl)-2-(2-methoxy-5-methylphenyl)ethanol
CID 65101453
2-(5-chloro-2-methoxyphenyl)-1-(3-fluorophenyl)ethanol
CID 62607764

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluoro-4-methoxyphenyl)-2-(3-fluorophenyl)ethanol?
The IUPAC name of 1-(3-fluoro-4-methoxyphenyl)-2-(3-fluorophenyl)ethanol (CID 61082269) is 1-(3-fluoro-4-methoxyphenyl)-2-(3-fluorophenyl)ethanol.
What is the SMILES notation for 1-(3-fluoro-4-methoxyphenyl)-2-(3-fluorophenyl)ethanol?
The canonical SMILES for 1-(3-fluoro-4-methoxyphenyl)-2-(3-fluorophenyl)ethanol is COc1ccc(C(O)Cc2cccc(F)c2)cc1F.
What is the InChIKey of 1-(3-fluoro-4-methoxyphenyl)-2-(3-fluorophenyl)ethanol?
The InChIKey is NJNFEGBGTIOROJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2O2/c1-19-15-6-5-11(9-13(15)17)14(18)8-10-3-2-4-12(16)7-10/h2-7,9,14,18H,8H2,1H3.
What are the key properties of 1-(3-fluoro-4-methoxyphenyl)-2-(3-fluorophenyl)ethanol?
1-(3-fluoro-4-methoxyphenyl)-2-(3-fluorophenyl)ethanol has a molecular weight of 264.27 g/mol, XLogP of 3.25, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluoro-4-methoxyphenyl)-2-(3-fluorophenyl)ethanol is sourced from PubChem (CID 61082269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).