2,3-difluoro-5-phenylphenol

C12H8F2O — CID 46314774

IUPAC2,3-difluoro-5-phenylphenol
SMILESOc1cc(-c2ccccc2)cc(F)c1F
InChIInChI=1S/C12H8F2O/c13-10-6-9(7-11(15)12(10)14)8-4-2-1-3-5-8/h1-7,15H
InChIKeyQVDXPVSNDHJQQV-UHFFFAOYSA-N
MW206.19 g/mol
LogP3.34
Rot. Bonds1

About 2,3-difluoro-5-phenylphenol

2,3-difluoro-5-phenylphenol (PubChem CID 46314774) has the molecular formula C12H8F2O and a molecular weight of 206.19 g/mol. Its IUPAC name is 2,3-difluoro-5-phenylphenol.

Molecular Properties

Compound Name2,3-difluoro-5-phenylphenol
PubChem CID46314774
Molecular FormulaC12H8F2O
Molecular Weight206.19 g/mol
Exact Mass206.05
IUPAC Name2,3-difluoro-5-phenylphenol
SMILESOc1cc(-c2ccccc2)cc(F)c1F
InChIInChI=1S/C12H8F2O/c13-10-6-9(7-11(15)12(10)14)8-4-2-1-3-5-8/h1-7,15H
InChIKeyQVDXPVSNDHJQQV-UHFFFAOYSA-N
XLogP3.34
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.19
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,3-difluoro-5-phenylphenol?
The IUPAC name of 2,3-difluoro-5-phenylphenol (CID 46314774) is 2,3-difluoro-5-phenylphenol.
What is the SMILES notation for 2,3-difluoro-5-phenylphenol?
The canonical SMILES for 2,3-difluoro-5-phenylphenol is Oc1cc(-c2ccccc2)cc(F)c1F.
What is the InChIKey of 2,3-difluoro-5-phenylphenol?
The InChIKey is QVDXPVSNDHJQQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8F2O/c13-10-6-9(7-11(15)12(10)14)8-4-2-1-3-5-8/h1-7,15H.
What are the key properties of 2,3-difluoro-5-phenylphenol?
2,3-difluoro-5-phenylphenol has a molecular weight of 206.19 g/mol, XLogP of 3.34, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-difluoro-5-phenylphenol is sourced from PubChem (CID 46314774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).