1-(4-ethoxyphenyl)-2-(3-fluorophenyl)ethanol

C16H17FO2 — CID 61099189

IUPAC1-(4-ethoxyphenyl)-2-(3-fluorophenyl)ethanol
SMILESCCOc1ccc(C(O)Cc2cccc(F)c2)cc1
InChIInChI=1S/C16H17FO2/c1-2-19-15-8-6-13(7-9-15)16(18)11-12-4-3-5-14(17)10-12/h3-10,16,18H,2,11H2,1H3
InChIKeyJSFWKBZFVMUGOW-UHFFFAOYSA-N
MW260.31 g/mol
LogP3.50
Rot. Bonds5

About 1-(4-ethoxyphenyl)-2-(3-fluorophenyl)ethanol

1-(4-ethoxyphenyl)-2-(3-fluorophenyl)ethanol (PubChem CID 61099189) has the molecular formula C16H17FO2 and a molecular weight of 260.31 g/mol. Its IUPAC name is 1-(4-ethoxyphenyl)-2-(3-fluorophenyl)ethanol.

Molecular Properties

Compound Name1-(4-ethoxyphenyl)-2-(3-fluorophenyl)ethanol
PubChem CID61099189
Molecular FormulaC16H17FO2
Molecular Weight260.31 g/mol
Exact Mass260.12
IUPAC Name1-(4-ethoxyphenyl)-2-(3-fluorophenyl)ethanol
SMILESCCOc1ccc(C(O)Cc2cccc(F)c2)cc1
InChIInChI=1S/C16H17FO2/c1-2-19-15-8-6-13(7-9-15)16(18)11-12-4-3-5-14(17)10-12/h3-10,16,18H,2,11H2,1H3
InChIKeyJSFWKBZFVMUGOW-UHFFFAOYSA-N
XLogP3.50
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.31
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-ethoxyphenyl)-2-(4-fluoro-2-methylphenyl)ethanol
CID 114346759
1-(3,5-dimethoxyphenyl)-2-(3-fluorophenyl)ethanol
CID 63016216
2-(2-bromo-5-fluorophenyl)-1-(4-ethoxyphenyl)ethanol
CID 65146117
2-(2-chloro-6-fluorophenyl)-1-(4-ethoxyphenyl)ethanol
CID 61099366
1-[2-bromo-2-(4-butoxyphenyl)ethyl]-3-fluorobenzene
CID 63543665
[2-(3-fluorophenyl)-1-(4-propoxyphenyl)ethyl]hydrazine
CID 105204863
2-(4-ethoxy-2-methylphenyl)-3-(3-fluorophenyl)propan-1-amine
CID 83974319
(4-ethoxyphenyl)-[3-(2-methylpropyl)phenyl]methanol
CID 116542362
1-(3-fluoro-4-methoxyphenyl)-2-(3-fluorophenyl)ethanol
CID 61082269
4-ethoxy-N-[1-(3-fluorophenyl)propan-2-yl]-2-methylaniline
CID 114829365
N-[2-(4-ethoxyanilino)-2-oxoethyl]-3-(3-fluorophenyl)-2-methylpropanamide
CID 48863912
1-(4-butoxyphenyl)-2-(4-fluorophenyl)ethanol
CID 63017882

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethoxyphenyl)-2-(3-fluorophenyl)ethanol?
The IUPAC name of 1-(4-ethoxyphenyl)-2-(3-fluorophenyl)ethanol (CID 61099189) is 1-(4-ethoxyphenyl)-2-(3-fluorophenyl)ethanol.
What is the SMILES notation for 1-(4-ethoxyphenyl)-2-(3-fluorophenyl)ethanol?
The canonical SMILES for 1-(4-ethoxyphenyl)-2-(3-fluorophenyl)ethanol is CCOc1ccc(C(O)Cc2cccc(F)c2)cc1.
What is the InChIKey of 1-(4-ethoxyphenyl)-2-(3-fluorophenyl)ethanol?
The InChIKey is JSFWKBZFVMUGOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FO2/c1-2-19-15-8-6-13(7-9-15)16(18)11-12-4-3-5-14(17)10-12/h3-10,16,18H,2,11H2,1H3.
What are the key properties of 1-(4-ethoxyphenyl)-2-(3-fluorophenyl)ethanol?
1-(4-ethoxyphenyl)-2-(3-fluorophenyl)ethanol has a molecular weight of 260.31 g/mol, XLogP of 3.50, 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-(3-fluorophenyl)ethanol is sourced from PubChem (CID 61099189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).