2,5-difluoro-4-(2-fluoro-4-hydroxyphenyl)phenol

C12H7F3O2 — CID 118286159

IUPAC2,5-difluoro-4-(2-fluoro-4-hydroxyphenyl)phenol
SMILESOc1ccc(-c2cc(F)c(O)cc2F)c(F)c1
InChIInChI=1S/C12H7F3O2/c13-9-3-6(16)1-2-7(9)8-4-11(15)12(17)5-10(8)14/h1-5,16-17H
InChIKeyQWHTWDHKOGGDMC-UHFFFAOYSA-N
MW240.18 g/mol
LogP3.18
Rot. Bonds1

About 2,5-difluoro-4-(2-fluoro-4-hydroxyphenyl)phenol

2,5-difluoro-4-(2-fluoro-4-hydroxyphenyl)phenol (PubChem CID 118286159) has the molecular formula C12H7F3O2 and a molecular weight of 240.18 g/mol. Its IUPAC name is 2,5-difluoro-4-(2-fluoro-4-hydroxyphenyl)phenol.

Molecular Properties

Compound Name2,5-difluoro-4-(2-fluoro-4-hydroxyphenyl)phenol
PubChem CID118286159
Molecular FormulaC12H7F3O2
Molecular Weight240.18 g/mol
Exact Mass240.04
IUPAC Name2,5-difluoro-4-(2-fluoro-4-hydroxyphenyl)phenol
SMILESOc1ccc(-c2cc(F)c(O)cc2F)c(F)c1
InChIInChI=1S/C12H7F3O2/c13-9-3-6(16)1-2-7(9)8-4-11(15)12(17)5-10(8)14/h1-5,16-17H
InChIKeyQWHTWDHKOGGDMC-UHFFFAOYSA-N
XLogP3.18
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.18
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,5-difluoro-4-(2-fluoro-4-hydroxyphenyl)phenol?
The IUPAC name of 2,5-difluoro-4-(2-fluoro-4-hydroxyphenyl)phenol (CID 118286159) is 2,5-difluoro-4-(2-fluoro-4-hydroxyphenyl)phenol.
What is the SMILES notation for 2,5-difluoro-4-(2-fluoro-4-hydroxyphenyl)phenol?
The canonical SMILES for 2,5-difluoro-4-(2-fluoro-4-hydroxyphenyl)phenol is Oc1ccc(-c2cc(F)c(O)cc2F)c(F)c1.
What is the InChIKey of 2,5-difluoro-4-(2-fluoro-4-hydroxyphenyl)phenol?
The InChIKey is QWHTWDHKOGGDMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7F3O2/c13-9-3-6(16)1-2-7(9)8-4-11(15)12(17)5-10(8)14/h1-5,16-17H.
What are the key properties of 2,5-difluoro-4-(2-fluoro-4-hydroxyphenyl)phenol?
2,5-difluoro-4-(2-fluoro-4-hydroxyphenyl)phenol has a molecular weight of 240.18 g/mol, XLogP of 3.18, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-difluoro-4-(2-fluoro-4-hydroxyphenyl)phenol is sourced from PubChem (CID 118286159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).