2,4-difluoro-1-(2-propan-2-ylphenoxy)benzene

C15H14F2O — CID 54486908

IUPAC2,4-difluoro-1-(2-propan-2-ylphenoxy)benzene
SMILESCC(C)c1ccccc1Oc1ccc(F)cc1F
InChIInChI=1S/C15H14F2O/c1-10(2)12-5-3-4-6-14(12)18-15-8-7-11(16)9-13(15)17/h3-10H,1-2H3
InChIKeyIEYWPWAVGYNSMI-UHFFFAOYSA-N
MW248.27 g/mol
LogP4.88
Rot. Bonds3

About 2,4-difluoro-1-(2-propan-2-ylphenoxy)benzene

2,4-difluoro-1-(2-propan-2-ylphenoxy)benzene (PubChem CID 54486908) has the molecular formula C15H14F2O and a molecular weight of 248.27 g/mol. Its IUPAC name is 2,4-difluoro-1-(2-propan-2-ylphenoxy)benzene.

Molecular Properties

Compound Name2,4-difluoro-1-(2-propan-2-ylphenoxy)benzene
PubChem CID54486908
Molecular FormulaC15H14F2O
Molecular Weight248.27 g/mol
Exact Mass248.10
IUPAC Name2,4-difluoro-1-(2-propan-2-ylphenoxy)benzene
SMILESCC(C)c1ccccc1Oc1ccc(F)cc1F
InChIInChI=1S/C15H14F2O/c1-10(2)12-5-3-4-6-14(12)18-15-8-7-11(16)9-13(15)17/h3-10H,1-2H3
InChIKeyIEYWPWAVGYNSMI-UHFFFAOYSA-N
XLogP4.88
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.27
LogP ≤ 54.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-[3-fluoro-4-(2-propan-2-ylphenoxy)phenyl]ethanol
CID 43506531
(1S)-1-[3-fluoro-4-(2-propan-2-ylphenoxy)phenyl]ethanol
CID 78941700
4-(chloromethyl)-2-fluoro-1-(2-propan-2-ylphenoxy)benzene
CID 28947258
2-[5-fluoro-2-(2-propan-2-ylphenoxy)phenyl]ethanamine
CID 63803297
3-fluoro-4-(2-propan-2-ylphenoxy)benzenecarbothioamide
CID 43658061
1-[2-(2,5-difluorophenoxy)phenyl]ethanamine
CID 55168326
(1S)-1-[2-fluoro-6-(2-propan-2-ylphenoxy)phenyl]ethanol
CID 78941712
1-[2-fluoro-6-(2-propan-2-ylphenoxy)phenyl]ethanol
CID 43506529
4-fluoro-1-methoxy-2-propan-2-ylbenzene
CID 53399241
N-[[2-(2,4-difluorophenoxy)phenyl]methyl]-2-methylpropan-1-amine
CID 63552912
(1R)-1-[2-(2-chloro-4-fluorophenoxy)phenyl]ethanol
CID 78941796
3-fluoro-4-[2-(1-hydroxyethyl)phenoxy]benzonitrile
CID 107666090

Frequently Asked Questions

What is the IUPAC name of 2,4-difluoro-1-(2-propan-2-ylphenoxy)benzene?
The IUPAC name of 2,4-difluoro-1-(2-propan-2-ylphenoxy)benzene (CID 54486908) is 2,4-difluoro-1-(2-propan-2-ylphenoxy)benzene.
What is the SMILES notation for 2,4-difluoro-1-(2-propan-2-ylphenoxy)benzene?
The canonical SMILES for 2,4-difluoro-1-(2-propan-2-ylphenoxy)benzene is CC(C)c1ccccc1Oc1ccc(F)cc1F.
What is the InChIKey of 2,4-difluoro-1-(2-propan-2-ylphenoxy)benzene?
The InChIKey is IEYWPWAVGYNSMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2O/c1-10(2)12-5-3-4-6-14(12)18-15-8-7-11(16)9-13(15)17/h3-10H,1-2H3.
What are the key properties of 2,4-difluoro-1-(2-propan-2-ylphenoxy)benzene?
2,4-difluoro-1-(2-propan-2-ylphenoxy)benzene has a molecular weight of 248.27 g/mol, XLogP of 4.88, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-difluoro-1-(2-propan-2-ylphenoxy)benzene is sourced from PubChem (CID 54486908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).