2-(3-fluorophenoxy)-1-(2-fluorophenyl)ethanol

C14H12F2O2 — CID 110885745

IUPAC2-(3-fluorophenoxy)-1-(2-fluorophenyl)ethanol
SMILESOC(COc1cccc(F)c1)c1ccccc1F
InChIInChI=1S/C14H12F2O2/c15-10-4-3-5-11(8-10)18-9-14(17)12-6-1-2-7-13(12)16/h1-8,14,17H,9H2
InChIKeyRMFHBSZTWROYQI-UHFFFAOYSA-N
MW250.24 g/mol
LogP3.08
Rot. Bonds4

About 2-(3-fluorophenoxy)-1-(2-fluorophenyl)ethanol

2-(3-fluorophenoxy)-1-(2-fluorophenyl)ethanol (PubChem CID 110885745) has the molecular formula C14H12F2O2 and a molecular weight of 250.24 g/mol. Its IUPAC name is 2-(3-fluorophenoxy)-1-(2-fluorophenyl)ethanol.

Molecular Properties

Compound Name2-(3-fluorophenoxy)-1-(2-fluorophenyl)ethanol
PubChem CID110885745
Molecular FormulaC14H12F2O2
Molecular Weight250.24 g/mol
Exact Mass250.08
IUPAC Name2-(3-fluorophenoxy)-1-(2-fluorophenyl)ethanol
SMILESOC(COc1cccc(F)c1)c1ccccc1F
InChIInChI=1S/C14H12F2O2/c15-10-4-3-5-11(8-10)18-9-14(17)12-6-1-2-7-13(12)16/h1-8,14,17H,9H2
InChIKeyRMFHBSZTWROYQI-UHFFFAOYSA-N
XLogP3.08
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.24
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3,4-difluorophenoxy)-1-(2-fluorophenyl)ethanol
CID 109414968
(1R)-1-(2-fluorophenyl)-2-(3-methylsulfonylphenoxy)ethanol
CID 97243469
1-(2-fluorophenyl)-2-pyridin-3-yloxyethanol
CID 117243776
N,N-diethyl-3-[2-(2-fluorophenyl)-2-hydroxyethoxy]benzamide
CID 109416737
1-(2,5-difluorophenyl)-2-(2-fluorophenoxy)ethanol
CID 109412674
2-(3,4-difluorophenoxy)-1-(2,5-difluorophenyl)ethanol
CID 109414944
1-(2,4-difluorophenyl)-2-(2-fluorophenoxy)ethanol
CID 109412665
4-[2-(2-fluorophenyl)-2-hydroxyethoxy]benzaldehyde
CID 86645072
1-amino-3-(3-fluorophenoxy)propan-2-ol
CID 16784461
1-(2,5-difluorophenyl)-2-(3-methylsulfonylphenoxy)ethanol
CID 109416332
4-(3-fluorophenoxy)butane-1,3-diol
CID 117236747
2-[1-hydroxy-2-(3-hydroxyphenoxy)ethyl]phenol
CID 117243718

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenoxy)-1-(2-fluorophenyl)ethanol?
The IUPAC name of 2-(3-fluorophenoxy)-1-(2-fluorophenyl)ethanol (CID 110885745) is 2-(3-fluorophenoxy)-1-(2-fluorophenyl)ethanol.
What is the SMILES notation for 2-(3-fluorophenoxy)-1-(2-fluorophenyl)ethanol?
The canonical SMILES for 2-(3-fluorophenoxy)-1-(2-fluorophenyl)ethanol is OC(COc1cccc(F)c1)c1ccccc1F.
What is the InChIKey of 2-(3-fluorophenoxy)-1-(2-fluorophenyl)ethanol?
The InChIKey is RMFHBSZTWROYQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12F2O2/c15-10-4-3-5-11(8-10)18-9-14(17)12-6-1-2-7-13(12)16/h1-8,14,17H,9H2.
What are the key properties of 2-(3-fluorophenoxy)-1-(2-fluorophenyl)ethanol?
2-(3-fluorophenoxy)-1-(2-fluorophenyl)ethanol has a molecular weight of 250.24 g/mol, XLogP of 3.08, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenoxy)-1-(2-fluorophenyl)ethanol is sourced from PubChem (CID 110885745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).