2,3-difluoro-4-[2-(trifluoromethoxy)phenyl]phenol

C13H7F5O2 — CID 119015626

IUPAC2,3-difluoro-4-[2-(trifluoromethoxy)phenyl]phenol
SMILESOc1ccc(-c2ccccc2OC(F)(F)F)c(F)c1F
InChIInChI=1S/C13H7F5O2/c14-11-8(5-6-9(19)12(11)15)7-3-1-2-4-10(7)20-13(16,17)18/h1-6,19H
InChIKeyLCNDBHNJPKACRB-UHFFFAOYSA-N
MW290.19 g/mol
LogP4.24
Rot. Bonds2

About 2,3-difluoro-4-[2-(trifluoromethoxy)phenyl]phenol

2,3-difluoro-4-[2-(trifluoromethoxy)phenyl]phenol (PubChem CID 119015626) has the molecular formula C13H7F5O2 and a molecular weight of 290.19 g/mol. Its IUPAC name is 2,3-difluoro-4-[2-(trifluoromethoxy)phenyl]phenol.

Molecular Properties

Compound Name2,3-difluoro-4-[2-(trifluoromethoxy)phenyl]phenol
PubChem CID119015626
Molecular FormulaC13H7F5O2
Molecular Weight290.19 g/mol
Exact Mass290.04
IUPAC Name2,3-difluoro-4-[2-(trifluoromethoxy)phenyl]phenol
SMILESOc1ccc(-c2ccccc2OC(F)(F)F)c(F)c1F
InChIInChI=1S/C13H7F5O2/c14-11-8(5-6-9(19)12(11)15)7-3-1-2-4-10(7)20-13(16,17)18/h1-6,19H
InChIKeyLCNDBHNJPKACRB-UHFFFAOYSA-N
XLogP4.24
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.19
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2,3-difluoro-4-[2-(trifluoromethoxy)phenyl]phenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(trifluoromethoxy)-2-[2-(trifluoromethoxy)phenyl]benzene
CID 18785200
5-(trifluoromethoxy)-2-[2-(trifluoromethoxy)phenyl]phenol
CID 171115606
4-hydroxy-3-[2-(trifluoromethoxy)phenyl]benzonitrile
CID 134626617
2-[2-(trifluoromethoxy)phenyl]-6-(trifluoromethyl)phenol
CID 134620434
6-fluoro-5-[2-(trifluoromethoxy)phenyl]pyridine-2-carboxylic acid
CID 133089211
[2-[2-(trifluoromethoxy)phenyl]phenyl]azanium
CID 147037666
1-(trifluoromethoxy)-2-[2-(trifluoromethyl)phenyl]benzene
CID 91059190
4-(chloromethyl)-2-fluoro-1-[2-(trifluoromethoxy)phenyl]benzene
CID 134628055
4-fluoro-3-[2-(trifluoromethoxy)phenyl]aniline
CID 112694311
1,3-difluoro-2-[2-(trifluoromethoxy)phenyl]benzene
CID 22617307
4-fluoro-2,6-bis[2-(trifluoromethoxy)phenyl]pyridine
CID 133088911
2-(bromomethyl)-4-fluoro-1-[2-(trifluoromethoxy)phenyl]benzene
CID 134619444

Frequently Asked Questions

What is the IUPAC name of 2,3-difluoro-4-[2-(trifluoromethoxy)phenyl]phenol?
The IUPAC name of 2,3-difluoro-4-[2-(trifluoromethoxy)phenyl]phenol (CID 119015626) is 2,3-difluoro-4-[2-(trifluoromethoxy)phenyl]phenol.
What is the SMILES notation for 2,3-difluoro-4-[2-(trifluoromethoxy)phenyl]phenol?
The canonical SMILES for 2,3-difluoro-4-[2-(trifluoromethoxy)phenyl]phenol is Oc1ccc(-c2ccccc2OC(F)(F)F)c(F)c1F.
What is the InChIKey of 2,3-difluoro-4-[2-(trifluoromethoxy)phenyl]phenol?
The InChIKey is LCNDBHNJPKACRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H7F5O2/c14-11-8(5-6-9(19)12(11)15)7-3-1-2-4-10(7)20-13(16,17)18/h1-6,19H.
What are the key properties of 2,3-difluoro-4-[2-(trifluoromethoxy)phenyl]phenol?
2,3-difluoro-4-[2-(trifluoromethoxy)phenyl]phenol has a molecular weight of 290.19 g/mol, XLogP of 4.24, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-difluoro-4-[2-(trifluoromethoxy)phenyl]phenol is sourced from PubChem (CID 119015626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).