2-(2,6-dichlorophenyl)-4,5-difluorophenol

C12H6Cl2F2O — CID 119020027

IUPAC2-(2,6-dichlorophenyl)-4,5-difluorophenol
SMILESOc1cc(F)c(F)cc1-c1c(Cl)cccc1Cl
InChIInChI=1S/C12H6Cl2F2O/c13-7-2-1-3-8(14)12(7)6-4-9(15)10(16)5-11(6)17/h1-5,17H
InChIKeyUFJIMFSVGNNECH-UHFFFAOYSA-N
MW275.08 g/mol
LogP4.64
Rot. Bonds1

About 2-(2,6-dichlorophenyl)-4,5-difluorophenol

2-(2,6-dichlorophenyl)-4,5-difluorophenol (PubChem CID 119020027) has the molecular formula C12H6Cl2F2O and a molecular weight of 275.08 g/mol. Its IUPAC name is 2-(2,6-dichlorophenyl)-4,5-difluorophenol.

Molecular Properties

Compound Name2-(2,6-dichlorophenyl)-4,5-difluorophenol
PubChem CID119020027
Molecular FormulaC12H6Cl2F2O
Molecular Weight275.08 g/mol
Exact Mass273.98
IUPAC Name2-(2,6-dichlorophenyl)-4,5-difluorophenol
SMILESOc1cc(F)c(F)cc1-c1c(Cl)cccc1Cl
InChIInChI=1S/C12H6Cl2F2O/c13-7-2-1-3-8(14)12(7)6-4-9(15)10(16)5-11(6)17/h1-5,17H
InChIKeyUFJIMFSVGNNECH-UHFFFAOYSA-N
XLogP4.64
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.08
LogP ≤ 54.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4,5-difluoro-2-(2,3,4,5,6-pentachlorophenyl)phenol
CID 118800996
1-(2,6-dichlorophenyl)-2,3,5-trifluorobenzene
CID 119023512
4-(2,6-dichlorophenyl)-3-fluorobenzoic acid
CID 119008734
4,5-difluoro-2-(2-fluorophenyl)phenol
CID 46312140
3-chloro-2-(2-chlorophenyl)phenol
CID 69117513
1-(2-chloro-6-fluorophenyl)-2,5-difluoro-4-methylbenzene
CID 103587069
sodium;3-(2,6-dichlorophenyl)-2-iodophenol;hydride
CID 173433912
3-(2-chloro-6-fluorophenyl)furan-2,4-diol
CID 117061781
4-chloro-2-(2-fluoro-6-methylphenyl)phenol
CID 146321741
4-(2,6-dichlorophenyl)-3-fluoropyridine
CID 133090517
3-(2,6-dichlorophenyl)-4-fluoropyridine
CID 133090486
2-(2-chlorophenyl)benzene-1,3-diol
CID 163363337

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dichlorophenyl)-4,5-difluorophenol?
The IUPAC name of 2-(2,6-dichlorophenyl)-4,5-difluorophenol (CID 119020027) is 2-(2,6-dichlorophenyl)-4,5-difluorophenol.
What is the SMILES notation for 2-(2,6-dichlorophenyl)-4,5-difluorophenol?
The canonical SMILES for 2-(2,6-dichlorophenyl)-4,5-difluorophenol is Oc1cc(F)c(F)cc1-c1c(Cl)cccc1Cl.
What is the InChIKey of 2-(2,6-dichlorophenyl)-4,5-difluorophenol?
The InChIKey is UFJIMFSVGNNECH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H6Cl2F2O/c13-7-2-1-3-8(14)12(7)6-4-9(15)10(16)5-11(6)17/h1-5,17H.
What are the key properties of 2-(2,6-dichlorophenyl)-4,5-difluorophenol?
2-(2,6-dichlorophenyl)-4,5-difluorophenol has a molecular weight of 275.08 g/mol, XLogP of 4.64, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dichlorophenyl)-4,5-difluorophenol is sourced from PubChem (CID 119020027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).