1-(2,4-difluorophenyl)-2-(2-fluorophenoxy)ethanol

C14H11F3O2 — CID 109412665

IUPAC1-(2,4-difluorophenyl)-2-(2-fluorophenoxy)ethanol
SMILESOC(COc1ccccc1F)c1ccc(F)cc1F
InChIInChI=1S/C14H11F3O2/c15-9-5-6-10(12(17)7-9)13(18)8-19-14-4-2-1-3-11(14)16/h1-7,13,18H,8H2
InChIKeyDIEIVEAFNNADIQ-UHFFFAOYSA-N
MW268.23 g/mol
LogP3.22
Rot. Bonds4

About 1-(2,4-difluorophenyl)-2-(2-fluorophenoxy)ethanol

1-(2,4-difluorophenyl)-2-(2-fluorophenoxy)ethanol (PubChem CID 109412665) has the molecular formula C14H11F3O2 and a molecular weight of 268.23 g/mol. Its IUPAC name is 1-(2,4-difluorophenyl)-2-(2-fluorophenoxy)ethanol.

Molecular Properties

Compound Name1-(2,4-difluorophenyl)-2-(2-fluorophenoxy)ethanol
PubChem CID109412665
Molecular FormulaC14H11F3O2
Molecular Weight268.23 g/mol
Exact Mass268.07
IUPAC Name1-(2,4-difluorophenyl)-2-(2-fluorophenoxy)ethanol
SMILESOC(COc1ccccc1F)c1ccc(F)cc1F
InChIInChI=1S/C14H11F3O2/c15-9-5-6-10(12(17)7-9)13(18)8-19-14-4-2-1-3-11(14)16/h1-7,13,18H,8H2
InChIKeyDIEIVEAFNNADIQ-UHFFFAOYSA-N
XLogP3.22
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.23
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,5-difluorophenyl)-2-(2-fluorophenoxy)ethanol
CID 109412674
1-(2,4-difluorophenyl)-2-(2-fluorophenyl)ethanol
CID 61086986
2-(3-fluorophenoxy)-1-(2-fluorophenyl)ethanol
CID 110885745
2-(2,4-difluorophenoxy)-1-(2,5-dimethoxyphenyl)ethanol
CID 110907757
1-(2,4-difluorophenoxy)-3-phenoxypropan-2-ol
CID 109415416
1-(2,4-difluorophenyl)-2-(4-methylsulfonylphenoxy)ethanol
CID 109415459
1-(2,5-difluorophenyl)-2-(2-nitrophenoxy)ethanol
CID 109412945
3-(2-fluorophenoxy)-2-hydroxypropan-1-olate
CID 45496401
1-(2,2-difluoroethoxy)-2-fluorobenzene
CID 64766194
2-(2,3-difluorophenoxy)-1-(2-methoxyphenyl)ethanol
CID 63038192
2-(2,3-difluorophenoxy)-1-(2,4-difluorophenyl)ethanamine
CID 107523625
2-(3,4-difluorophenoxy)-1-(2-fluorophenyl)ethanol
CID 109414968

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-difluorophenyl)-2-(2-fluorophenoxy)ethanol?
The IUPAC name of 1-(2,4-difluorophenyl)-2-(2-fluorophenoxy)ethanol (CID 109412665) is 1-(2,4-difluorophenyl)-2-(2-fluorophenoxy)ethanol.
What is the SMILES notation for 1-(2,4-difluorophenyl)-2-(2-fluorophenoxy)ethanol?
The canonical SMILES for 1-(2,4-difluorophenyl)-2-(2-fluorophenoxy)ethanol is OC(COc1ccccc1F)c1ccc(F)cc1F.
What is the InChIKey of 1-(2,4-difluorophenyl)-2-(2-fluorophenoxy)ethanol?
The InChIKey is DIEIVEAFNNADIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11F3O2/c15-9-5-6-10(12(17)7-9)13(18)8-19-14-4-2-1-3-11(14)16/h1-7,13,18H,8H2.
What are the key properties of 1-(2,4-difluorophenyl)-2-(2-fluorophenoxy)ethanol?
1-(2,4-difluorophenyl)-2-(2-fluorophenoxy)ethanol has a molecular weight of 268.23 g/mol, XLogP of 3.22, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-difluorophenyl)-2-(2-fluorophenoxy)ethanol is sourced from PubChem (CID 109412665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).