2-[4-(trifluoromethoxy)phenoxy]phenol

C13H9F3O3 — CID 19755907

IUPAC2-[4-(trifluoromethoxy)phenoxy]phenol
SMILESOc1ccccc1Oc1ccc(OC(F)(F)F)cc1
InChIInChI=1S/C13H9F3O3/c14-13(15,16)19-10-7-5-9(6-8-10)18-12-4-2-1-3-11(12)17/h1-8,17H
InChIKeyGNGLISMBGKDDNE-UHFFFAOYSA-N
MW270.21 g/mol
LogP4.08
Rot. Bonds3

About 2-[4-(trifluoromethoxy)phenoxy]phenol

2-[4-(trifluoromethoxy)phenoxy]phenol (PubChem CID 19755907) has the molecular formula C13H9F3O3 and a molecular weight of 270.21 g/mol. Its IUPAC name is 2-[4-(trifluoromethoxy)phenoxy]phenol.

Molecular Properties

Compound Name2-[4-(trifluoromethoxy)phenoxy]phenol
PubChem CID19755907
Molecular FormulaC13H9F3O3
Molecular Weight270.21 g/mol
Exact Mass270.05
IUPAC Name2-[4-(trifluoromethoxy)phenoxy]phenol
SMILESOc1ccccc1Oc1ccc(OC(F)(F)F)cc1
InChIInChI=1S/C13H9F3O3/c14-13(15,16)19-10-7-5-9(6-8-10)18-12-4-2-1-3-11(12)17/h1-8,17H
InChIKeyGNGLISMBGKDDNE-UHFFFAOYSA-N
XLogP4.08
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.21
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-methoxyphenoxy)phenol
CID 54145402
2-(4-iodophenoxy)phenol
CID 90870706
2-[4-(trifluoromethoxy)phenyl]phenol
CID 23225048
5-(trifluoromethoxy)-2-[2-(trifluoromethoxy)phenyl]phenol
CID 171115606
trifluoromethoxybenzene
CID 157402708
2-[6-(2-hydroxyphenoxy)naphthalen-2-yl]oxyphenol
CID 175775609
2-[4-(2-phenylpropan-2-yl)phenoxy]phenol
CID 57058375
trifluoromethoxybenzene fluoride
CID 158305019
1-(trifluoromethoxy)-2-[4-(trifluoromethoxy)phenyl]benzene
CID 90959680
(R)-phenyl-[4-(trifluoromethoxy)phenyl]methanol
CID 95251088
4-(2-hydroxyphenoxy)benzaldehyde
CID 13266147
2-[[4-(trifluoromethoxy)phenyl]methyl]phenol
CID 67458560

Frequently Asked Questions

What is the IUPAC name of 2-[4-(trifluoromethoxy)phenoxy]phenol?
The IUPAC name of 2-[4-(trifluoromethoxy)phenoxy]phenol (CID 19755907) is 2-[4-(trifluoromethoxy)phenoxy]phenol.
What is the SMILES notation for 2-[4-(trifluoromethoxy)phenoxy]phenol?
The canonical SMILES for 2-[4-(trifluoromethoxy)phenoxy]phenol is Oc1ccccc1Oc1ccc(OC(F)(F)F)cc1.
What is the InChIKey of 2-[4-(trifluoromethoxy)phenoxy]phenol?
The InChIKey is GNGLISMBGKDDNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9F3O3/c14-13(15,16)19-10-7-5-9(6-8-10)18-12-4-2-1-3-11(12)17/h1-8,17H.
What are the key properties of 2-[4-(trifluoromethoxy)phenoxy]phenol?
2-[4-(trifluoromethoxy)phenoxy]phenol has a molecular weight of 270.21 g/mol, XLogP of 4.08, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(trifluoromethoxy)phenoxy]phenol is sourced from PubChem (CID 19755907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).