2-[4-(3-fluoropropyl)phenyl]ethanol

C11H15FO — CID 117279232

IUPAC2-[4-(3-fluoropropyl)phenyl]ethanol
SMILESOCCc1ccc(CCCF)cc1
InChIInChI=1S/C11H15FO/c12-8-1-2-10-3-5-11(6-4-10)7-9-13/h3-6,13H,1-2,7-9H2
InChIKeyDCVYPSYANZGKOI-UHFFFAOYSA-N
MW182.24 g/mol
LogP2.12
Rot. Bonds5

About 2-[4-(3-fluoropropyl)phenyl]ethanol

2-[4-(3-fluoropropyl)phenyl]ethanol (PubChem CID 117279232) has the molecular formula C11H15FO and a molecular weight of 182.24 g/mol. Its IUPAC name is 2-[4-(3-fluoropropyl)phenyl]ethanol.

Molecular Properties

Compound Name2-[4-(3-fluoropropyl)phenyl]ethanol
PubChem CID117279232
Molecular FormulaC11H15FO
Molecular Weight182.24 g/mol
Exact Mass182.11
IUPAC Name2-[4-(3-fluoropropyl)phenyl]ethanol
SMILESOCCc1ccc(CCCF)cc1
InChIInChI=1S/C11H15FO/c12-8-1-2-10-3-5-11(6-4-10)7-9-13/h3-6,13H,1-2,7-9H2
InChIKeyDCVYPSYANZGKOI-UHFFFAOYSA-N
XLogP2.12
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.24
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(3-fluoropropyl)phenyl]ethanol?
The IUPAC name of 2-[4-(3-fluoropropyl)phenyl]ethanol (CID 117279232) is 2-[4-(3-fluoropropyl)phenyl]ethanol.
What is the SMILES notation for 2-[4-(3-fluoropropyl)phenyl]ethanol?
The canonical SMILES for 2-[4-(3-fluoropropyl)phenyl]ethanol is OCCc1ccc(CCCF)cc1.
What is the InChIKey of 2-[4-(3-fluoropropyl)phenyl]ethanol?
The InChIKey is DCVYPSYANZGKOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15FO/c12-8-1-2-10-3-5-11(6-4-10)7-9-13/h3-6,13H,1-2,7-9H2.
What are the key properties of 2-[4-(3-fluoropropyl)phenyl]ethanol?
2-[4-(3-fluoropropyl)phenyl]ethanol has a molecular weight of 182.24 g/mol, XLogP of 2.12, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(3-fluoropropyl)phenyl]ethanol is sourced from PubChem (CID 117279232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).