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

C17H19FO2 — CID 62795916

IUPAC1-(4-fluorophenyl)-1-(4-propoxyphenyl)ethanol
SMILESCCCOc1ccc(C(C)(O)c2ccc(F)cc2)cc1
InChIInChI=1S/C17H19FO2/c1-3-12-20-16-10-6-14(7-11-16)17(2,19)13-4-8-15(18)9-5-13/h4-11,19H,3,12H2,1-2H3
InChIKeyOXMMBTKLHZFFHC-UHFFFAOYSA-N
MW274.34 g/mol
LogP3.87
Rot. Bonds5

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

1-(4-fluorophenyl)-1-(4-propoxyphenyl)ethanol (PubChem CID 62795916) has the molecular formula C17H19FO2 and a molecular weight of 274.34 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-1-(4-propoxyphenyl)ethanol.

Molecular Properties

Compound Name1-(4-fluorophenyl)-1-(4-propoxyphenyl)ethanol
PubChem CID62795916
Molecular FormulaC17H19FO2
Molecular Weight274.34 g/mol
Exact Mass274.14
IUPAC Name1-(4-fluorophenyl)-1-(4-propoxyphenyl)ethanol
SMILESCCCOc1ccc(C(C)(O)c2ccc(F)cc2)cc1
InChIInChI=1S/C17H19FO2/c1-3-12-20-16-10-6-14(7-11-16)17(2,19)13-4-8-15(18)9-5-13/h4-11,19H,3,12H2,1-2H3
InChIKeyOXMMBTKLHZFFHC-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-propoxyphenyl)ethanol
CID 104658477
1-(2-hydroperoxypropan-2-yl)-4-propoxybenzene
CID 11481238
2-hydroxy-2-(4-propoxyphenyl)propanoic acid
CID 61237802
1,1,1-trifluoro-2-(4-propoxyphenyl)butan-2-ol
CID 83957964
1-(1,1-difluoroethyl)-4-(4-propoxyphenyl)benzene
CID 23188574
2-amino-2-(4-propoxyphenyl)propan-1-ol
CID 61056640
1-fluoro-4-[2-[4-(4-propoxyphenyl)phenyl]ethynyl]benzene
CID 67865457
4-fluoro-N-[(4-propoxyphenyl)methyl]aniline
CID 40650179
4,4,5,5,6,6,7,7,7-nonafluoro-2-(4-propoxyphenyl)heptan-2-ol
CID 156764535
1-(4-fluorophenyl)-1-[4-(trifluoromethyl)phenyl]ethanol
CID 62787435
2-methyl-3-(4-propoxyphenyl)pentan-3-ol
CID 62796253
2-(4-propoxyphenyl)hex-5-en-2-ol
CID 104656350

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-1-(4-propoxyphenyl)ethanol?
The IUPAC name of 1-(4-fluorophenyl)-1-(4-propoxyphenyl)ethanol (CID 62795916) is 1-(4-fluorophenyl)-1-(4-propoxyphenyl)ethanol.
What is the SMILES notation for 1-(4-fluorophenyl)-1-(4-propoxyphenyl)ethanol?
The canonical SMILES for 1-(4-fluorophenyl)-1-(4-propoxyphenyl)ethanol is CCCOc1ccc(C(C)(O)c2ccc(F)cc2)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-1-(4-propoxyphenyl)ethanol?
The InChIKey is OXMMBTKLHZFFHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FO2/c1-3-12-20-16-10-6-14(7-11-16)17(2,19)13-4-8-15(18)9-5-13/h4-11,19H,3,12H2,1-2H3.
What are the key properties of 1-(4-fluorophenyl)-1-(4-propoxyphenyl)ethanol?
1-(4-fluorophenyl)-1-(4-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-(4-propoxyphenyl)ethanol is sourced from PubChem (CID 62795916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).