1-(4-fluorophenyl)-1-(2-propoxyphenyl)ethanol

C17H19FO2 — CID 104658477

IUPAC1-(4-fluorophenyl)-1-(2-propoxyphenyl)ethanol
SMILESCCCOc1ccccc1C(C)(O)c1ccc(F)cc1
InChIInChI=1S/C17H19FO2/c1-3-12-20-16-7-5-4-6-15(16)17(2,19)13-8-10-14(18)11-9-13/h4-11,19H,3,12H2,1-2H3
InChIKeyBHBCJOPEFQBNRO-UHFFFAOYSA-N
MW274.34 g/mol
LogP3.87
Rot. Bonds5

About 1-(4-fluorophenyl)-1-(2-propoxyphenyl)ethanol

1-(4-fluorophenyl)-1-(2-propoxyphenyl)ethanol (PubChem CID 104658477) has the molecular formula C17H19FO2 and a molecular weight of 274.34 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-1-(2-propoxyphenyl)ethanol.

Molecular Properties

Compound Name1-(4-fluorophenyl)-1-(2-propoxyphenyl)ethanol
PubChem CID104658477
Molecular FormulaC17H19FO2
Molecular Weight274.34 g/mol
Exact Mass274.14
IUPAC Name1-(4-fluorophenyl)-1-(2-propoxyphenyl)ethanol
SMILESCCCOc1ccccc1C(C)(O)c1ccc(F)cc1
InChIInChI=1S/C17H19FO2/c1-3-12-20-16-7-5-4-6-15(16)17(2,19)13-8-10-14(18)11-9-13/h4-11,19H,3,12H2,1-2H3
InChIKeyBHBCJOPEFQBNRO-UHFFFAOYSA-N
XLogP3.87
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 ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-fluorophenyl)-1-(2-methoxyphenyl)ethanol
CID 60793238
1-(4-fluorophenyl)-1-(4-propoxyphenyl)ethanol
CID 62795916
1-(3-methoxyphenyl)-1-(2-propoxyphenyl)ethanol
CID 104658498
1-(2-bromophenyl)-1-(4-fluorophenyl)ethanol
CID 60795081
2-methyl-2-(2-propoxyphenyl)propanoic acid
CID 104662391
1-(3-fluorophenyl)-1-(2-propoxyphenyl)ethanamine
CID 104659008
1-(4-tert-butylphenyl)-1-(2-methoxyphenyl)ethanol
CID 62549935
1-cyclohexyl-1-(2-propoxyphenyl)ethanol
CID 114794929
1-(4-methoxyphenyl)-1-(2-propoxyphenyl)ethanamine
CID 104659024
2-[1-(4-fluorophenyl)-1-hydroxybutyl]phenol
CID 155686228
1-(2,3-dichlorophenyl)-1-(4-fluorophenyl)ethanol
CID 55116262
1-(2-bromophenyl)-1-(2-propoxyphenyl)ethanamine
CID 104659022

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-1-(2-propoxyphenyl)ethanol?
The IUPAC name of 1-(4-fluorophenyl)-1-(2-propoxyphenyl)ethanol (CID 104658477) is 1-(4-fluorophenyl)-1-(2-propoxyphenyl)ethanol.
What is the SMILES notation for 1-(4-fluorophenyl)-1-(2-propoxyphenyl)ethanol?
The canonical SMILES for 1-(4-fluorophenyl)-1-(2-propoxyphenyl)ethanol is CCCOc1ccccc1C(C)(O)c1ccc(F)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-1-(2-propoxyphenyl)ethanol?
The InChIKey is BHBCJOPEFQBNRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FO2/c1-3-12-20-16-7-5-4-6-15(16)17(2,19)13-8-10-14(18)11-9-13/h4-11,19H,3,12H2,1-2H3.
What are the key properties of 1-(4-fluorophenyl)-1-(2-propoxyphenyl)ethanol?
1-(4-fluorophenyl)-1-(2-propoxyphenyl)ethanol has a molecular weight of 274.34 g/mol, XLogP of 3.87, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-1-(2-propoxyphenyl)ethanol is sourced from PubChem (CID 104658477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).