2-[2,3,5,6-tetrafluoro-4-[2,3,5,6-tetrafluoro-4-(2-hydroxyphenoxy)phenyl]phenoxy]phenol

C24H10F8O4 — CID 3092907

IUPAC2-[2,3,5,6-tetrafluoro-4-[2,3,5,6-tetrafluoro-4-(2-hydroxyphenoxy)phenyl]phenoxy]phenol
SMILESOc1ccccc1Oc1c(F)c(F)c(-c2c(F)c(F)c(Oc3ccccc3O)c(F)c2F)c(F)c1F
InChIInChI=1S/C24H10F8O4/c25-15-13(16(26)20(30)23(19(15)29)35-11-7-3-1-5-9(11)33)14-17(27)21(31)24(22(32)18(14)28)36-12-8-4-2-6-10(12)34/h1-8,33-34H
InChIKeyBFTIIWNDUAJKAJ-UHFFFAOYSA-N
MW514.32 g/mol
LogP7.46
Rot. Bonds5

About 2-[2,3,5,6-tetrafluoro-4-[2,3,5,6-tetrafluoro-4-(2-hydroxyphenoxy)phenyl]phenoxy]phenol

2-[2,3,5,6-tetrafluoro-4-[2,3,5,6-tetrafluoro-4-(2-hydroxyphenoxy)phenyl]phenoxy]phenol (PubChem CID 3092907) has the molecular formula C24H10F8O4 and a molecular weight of 514.32 g/mol. Its IUPAC name is 2-[2,3,5,6-tetrafluoro-4-[2,3,5,6-tetrafluoro-4-(2-hydroxyphenoxy)phenyl]phenoxy]phenol.

Molecular Properties

Compound Name2-[2,3,5,6-tetrafluoro-4-[2,3,5,6-tetrafluoro-4-(2-hydroxyphenoxy)phenyl]phenoxy]phenol
PubChem CID3092907
Molecular FormulaC24H10F8O4
Molecular Weight514.32 g/mol
Exact Mass514.05
IUPAC Name2-[2,3,5,6-tetrafluoro-4-[2,3,5,6-tetrafluoro-4-(2-hydroxyphenoxy)phenyl]phenoxy]phenol
SMILESOc1ccccc1Oc1c(F)c(F)c(-c2c(F)c(F)c(Oc3ccccc3O)c(F)c2F)c(F)c1F
InChIInChI=1S/C24H10F8O4/c25-15-13(16(26)20(30)23(19(15)29)35-11-7-3-1-5-9(11)33)14-17(27)21(31)24(22(32)18(14)28)36-12-8-4-2-6-10(12)34/h1-8,33-34H
InChIKeyBFTIIWNDUAJKAJ-UHFFFAOYSA-N
XLogP7.46
TPSA58.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms36
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500514.32
LogP ≤ 57.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}

Analyze 2-[2,3,5,6-tetrafluoro-4-[2,3,5,6-tetrafluoro-4-(2-hydroxyphenoxy)phenyl]phenoxy]phenol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[2,3,5,6-tetrafluoro-4-[2,3,5,6-tetrafluoro-4-(2-hydroxyphenoxy)phenyl]phenoxy]phenol?
The IUPAC name of 2-[2,3,5,6-tetrafluoro-4-[2,3,5,6-tetrafluoro-4-(2-hydroxyphenoxy)phenyl]phenoxy]phenol (CID 3092907) is 2-[2,3,5,6-tetrafluoro-4-[2,3,5,6-tetrafluoro-4-(2-hydroxyphenoxy)phenyl]phenoxy]phenol.
What is the SMILES notation for 2-[2,3,5,6-tetrafluoro-4-[2,3,5,6-tetrafluoro-4-(2-hydroxyphenoxy)phenyl]phenoxy]phenol?
The canonical SMILES for 2-[2,3,5,6-tetrafluoro-4-[2,3,5,6-tetrafluoro-4-(2-hydroxyphenoxy)phenyl]phenoxy]phenol is Oc1ccccc1Oc1c(F)c(F)c(-c2c(F)c(F)c(Oc3ccccc3O)c(F)c2F)c(F)c1F.
What is the InChIKey of 2-[2,3,5,6-tetrafluoro-4-[2,3,5,6-tetrafluoro-4-(2-hydroxyphenoxy)phenyl]phenoxy]phenol?
The InChIKey is BFTIIWNDUAJKAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H10F8O4/c25-15-13(16(26)20(30)23(19(15)29)35-11-7-3-1-5-9(11)33)14-17(27)21(31)24(22(32)18(14)28)36-12-8-4-2-6-10(12)34/h1-8,33-34H.
What are the key properties of 2-[2,3,5,6-tetrafluoro-4-[2,3,5,6-tetrafluoro-4-(2-hydroxyphenoxy)phenyl]phenoxy]phenol?
2-[2,3,5,6-tetrafluoro-4-[2,3,5,6-tetrafluoro-4-(2-hydroxyphenoxy)phenyl]phenoxy]phenol has a molecular weight of 514.32 g/mol, XLogP of 7.46, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2,3,5,6-tetrafluoro-4-[2,3,5,6-tetrafluoro-4-(2-hydroxyphenoxy)phenyl]phenoxy]phenol is sourced from PubChem (CID 3092907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).