4-(2,6-difluoro-4-hydroxyphenyl)-3,5-difluorophenol

C12H6F4O2 — CID 22708583

IUPAC4-(2,6-difluoro-4-hydroxyphenyl)-3,5-difluorophenol
SMILESOc1cc(F)c(-c2c(F)cc(O)cc2F)c(F)c1
InChIInChI=1S/C12H6F4O2/c13-7-1-5(17)2-8(14)11(7)12-9(15)3-6(18)4-10(12)16/h1-4,17-18H
InChIKeyRMFKONDLPMDUJM-UHFFFAOYSA-N
MW258.17 g/mol
LogP3.32
Rot. Bonds1

About 4-(2,6-difluoro-4-hydroxyphenyl)-3,5-difluorophenol

4-(2,6-difluoro-4-hydroxyphenyl)-3,5-difluorophenol (PubChem CID 22708583) has the molecular formula C12H6F4O2 and a molecular weight of 258.17 g/mol. Its IUPAC name is 4-(2,6-difluoro-4-hydroxyphenyl)-3,5-difluorophenol.

Molecular Properties

Compound Name4-(2,6-difluoro-4-hydroxyphenyl)-3,5-difluorophenol
PubChem CID22708583
Molecular FormulaC12H6F4O2
Molecular Weight258.17 g/mol
Exact Mass258.03
IUPAC Name4-(2,6-difluoro-4-hydroxyphenyl)-3,5-difluorophenol
SMILESOc1cc(F)c(-c2c(F)cc(O)cc2F)c(F)c1
InChIInChI=1S/C12H6F4O2/c13-7-1-5(17)2-8(14)11(7)12-9(15)3-6(18)4-10(12)16/h1-4,17-18H
InChIKeyRMFKONDLPMDUJM-UHFFFAOYSA-N
XLogP3.32
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.17
LogP ≤ 53.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-(2,6-difluoro-4-hydroxyphenyl)-3,5-difluorophenol 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 4-(2,6-difluoro-4-hydroxyphenyl)-3,5-difluorophenol?
The IUPAC name of 4-(2,6-difluoro-4-hydroxyphenyl)-3,5-difluorophenol (CID 22708583) is 4-(2,6-difluoro-4-hydroxyphenyl)-3,5-difluorophenol.
What is the SMILES notation for 4-(2,6-difluoro-4-hydroxyphenyl)-3,5-difluorophenol?
The canonical SMILES for 4-(2,6-difluoro-4-hydroxyphenyl)-3,5-difluorophenol is Oc1cc(F)c(-c2c(F)cc(O)cc2F)c(F)c1.
What is the InChIKey of 4-(2,6-difluoro-4-hydroxyphenyl)-3,5-difluorophenol?
The InChIKey is RMFKONDLPMDUJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H6F4O2/c13-7-1-5(17)2-8(14)11(7)12-9(15)3-6(18)4-10(12)16/h1-4,17-18H.
What are the key properties of 4-(2,6-difluoro-4-hydroxyphenyl)-3,5-difluorophenol?
4-(2,6-difluoro-4-hydroxyphenyl)-3,5-difluorophenol has a molecular weight of 258.17 g/mol, XLogP of 3.32, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,6-difluoro-4-hydroxyphenyl)-3,5-difluorophenol is sourced from PubChem (CID 22708583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).