2,5-dichloro-4-(2-fluorophenyl)phenol

C12H7Cl2FO — CID 107663319

IUPAC2,5-dichloro-4-(2-fluorophenyl)phenol
SMILESOc1cc(Cl)c(-c2ccccc2F)cc1Cl
InChIInChI=1S/C12H7Cl2FO/c13-9-6-12(16)10(14)5-8(9)7-3-1-2-4-11(7)15/h1-6,16H
InChIKeyDGDTZDIWLBDJFF-UHFFFAOYSA-N
MW257.09 g/mol
LogP4.51
Rot. Bonds1

About 2,5-dichloro-4-(2-fluorophenyl)phenol

2,5-dichloro-4-(2-fluorophenyl)phenol (PubChem CID 107663319) has the molecular formula C12H7Cl2FO and a molecular weight of 257.09 g/mol. Its IUPAC name is 2,5-dichloro-4-(2-fluorophenyl)phenol.

Molecular Properties

Compound Name2,5-dichloro-4-(2-fluorophenyl)phenol
PubChem CID107663319
Molecular FormulaC12H7Cl2FO
Molecular Weight257.09 g/mol
Exact Mass255.99
IUPAC Name2,5-dichloro-4-(2-fluorophenyl)phenol
SMILESOc1cc(Cl)c(-c2ccccc2F)cc1Cl
InChIInChI=1S/C12H7Cl2FO/c13-9-6-12(16)10(14)5-8(9)7-3-1-2-4-11(7)15/h1-6,16H
InChIKeyDGDTZDIWLBDJFF-UHFFFAOYSA-N
XLogP4.51
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.09
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,5-dichloro-4-(2-fluorophenyl)phenol?
The IUPAC name of 2,5-dichloro-4-(2-fluorophenyl)phenol (CID 107663319) is 2,5-dichloro-4-(2-fluorophenyl)phenol.
What is the SMILES notation for 2,5-dichloro-4-(2-fluorophenyl)phenol?
The canonical SMILES for 2,5-dichloro-4-(2-fluorophenyl)phenol is Oc1cc(Cl)c(-c2ccccc2F)cc1Cl.
What is the InChIKey of 2,5-dichloro-4-(2-fluorophenyl)phenol?
The InChIKey is DGDTZDIWLBDJFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7Cl2FO/c13-9-6-12(16)10(14)5-8(9)7-3-1-2-4-11(7)15/h1-6,16H.
What are the key properties of 2,5-dichloro-4-(2-fluorophenyl)phenol?
2,5-dichloro-4-(2-fluorophenyl)phenol has a molecular weight of 257.09 g/mol, XLogP of 4.51, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dichloro-4-(2-fluorophenyl)phenol is sourced from PubChem (CID 107663319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).