4-(2,2-difluoro-1-hydroxyethyl)-2-phenylphenol

C14H12F2O2 — CID 166522785

IUPAC4-(2,2-difluoro-1-hydroxyethyl)-2-phenylphenol
SMILESOc1ccc(C(O)C(F)F)cc1-c1ccccc1
InChIInChI=1S/C14H12F2O2/c15-14(16)13(18)10-6-7-12(17)11(8-10)9-4-2-1-3-5-9/h1-8,13-14,17-18H
InChIKeyZTLYVMGMTVCTBG-UHFFFAOYSA-N
MW250.24 g/mol
LogP3.36
Rot. Bonds3

About 4-(2,2-difluoro-1-hydroxyethyl)-2-phenylphenol

4-(2,2-difluoro-1-hydroxyethyl)-2-phenylphenol (PubChem CID 166522785) has the molecular formula C14H12F2O2 and a molecular weight of 250.24 g/mol. Its IUPAC name is 4-(2,2-difluoro-1-hydroxyethyl)-2-phenylphenol.

Molecular Properties

Compound Name4-(2,2-difluoro-1-hydroxyethyl)-2-phenylphenol
PubChem CID166522785
Molecular FormulaC14H12F2O2
Molecular Weight250.24 g/mol
Exact Mass250.08
IUPAC Name4-(2,2-difluoro-1-hydroxyethyl)-2-phenylphenol
SMILESOc1ccc(C(O)C(F)F)cc1-c1ccccc1
InChIInChI=1S/C14H12F2O2/c15-14(16)13(18)10-6-7-12(17)11(8-10)9-4-2-1-3-5-9/h1-8,13-14,17-18H
InChIKeyZTLYVMGMTVCTBG-UHFFFAOYSA-N
XLogP3.36
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.24
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-(2,2-difluoro-1-hydroxyethyl)-2-phenylphenol 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

4-[bis(4-hydroxy-3-phenylphenyl)methyl]-2-phenylphenol
CID 140882520
4-[1-(4-hydroxy-3-phenylphenyl)ethyl]-2-phenylphenol
CID 22492717
2-chloro-4-(2,2-difluoro-1-hydroxyethyl)phenol
CID 80605831
(1R)-2,2-difluoro-1-phenylethanol
CID 12955760
4-[[4-hydroxy-3-(4-phenylphenyl)phenyl]methyl]-2-(4-phenylphenyl)phenol
CID 121386312
4-(4-hydroxy-3-phenylphenyl)-2-methylphenol
CID 139534984
carbanide;2-phenylphenol;titanium(3+)
CID 59317555
4-[9-(4-hydroxy-3-phenylphenyl)nonyl]-2-phenylphenol
CID 70422254
4-[6-(4-hydroxy-3-phenylphenyl)hexyl]-2-phenylphenol
CID 139679162
4-[1-(4-hydroxy-3,5-diphenylphenyl)ethyl]-2,6-diphenylphenol
CID 139825093
2,6-diphenyl-4-propan-2-ylphenol
CID 155045328
1-(4-fluoro-3-phenylphenyl)-2-(methylamino)ethanol
CID 117365234

Frequently Asked Questions

What is the IUPAC name of 4-(2,2-difluoro-1-hydroxyethyl)-2-phenylphenol?
The IUPAC name of 4-(2,2-difluoro-1-hydroxyethyl)-2-phenylphenol (CID 166522785) is 4-(2,2-difluoro-1-hydroxyethyl)-2-phenylphenol.
What is the SMILES notation for 4-(2,2-difluoro-1-hydroxyethyl)-2-phenylphenol?
The canonical SMILES for 4-(2,2-difluoro-1-hydroxyethyl)-2-phenylphenol is Oc1ccc(C(O)C(F)F)cc1-c1ccccc1.
What is the InChIKey of 4-(2,2-difluoro-1-hydroxyethyl)-2-phenylphenol?
The InChIKey is ZTLYVMGMTVCTBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12F2O2/c15-14(16)13(18)10-6-7-12(17)11(8-10)9-4-2-1-3-5-9/h1-8,13-14,17-18H.
What are the key properties of 4-(2,2-difluoro-1-hydroxyethyl)-2-phenylphenol?
4-(2,2-difluoro-1-hydroxyethyl)-2-phenylphenol has a molecular weight of 250.24 g/mol, XLogP of 3.36, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,2-difluoro-1-hydroxyethyl)-2-phenylphenol is sourced from PubChem (CID 166522785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).