5-chloro-2-(4-chlorophenoxy)phenol

C12H8Cl2O2 — CID 18807

IUPAC5-chloro-2-(4-chlorophenoxy)phenol
SMILESOc1cc(Cl)ccc1Oc1ccc(Cl)cc1
InChIInChI=1S/C12H8Cl2O2/c13-8-1-4-10(5-2-8)16-12-6-3-9(14)7-11(12)15/h1-7,15H
InChIKeyBYNQFCJOHGOKSS-UHFFFAOYSA-N
MW255.10 g/mol
LogP4.49
Rot. Bonds2

About 5-chloro-2-(4-chlorophenoxy)phenol

5-chloro-2-(4-chlorophenoxy)phenol (PubChem CID 18807) has the molecular formula C12H8Cl2O2 and a molecular weight of 255.10 g/mol. Its IUPAC name is 5-chloro-2-(4-chlorophenoxy)phenol.

Molecular Properties

Compound Name5-chloro-2-(4-chlorophenoxy)phenol
PubChem CID18807
Molecular FormulaC12H8Cl2O2
Molecular Weight255.10 g/mol
Exact Mass253.99
IUPAC Name5-chloro-2-(4-chlorophenoxy)phenol
SMILESOc1cc(Cl)ccc1Oc1ccc(Cl)cc1
InChIInChI=1S/C12H8Cl2O2/c13-8-1-4-10(5-2-8)16-12-6-3-9(14)7-11(12)15/h1-7,15H
InChIKeyBYNQFCJOHGOKSS-UHFFFAOYSA-N
XLogP4.49
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.10
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-(4-chlorophenoxy)phenol?
The IUPAC name of 5-chloro-2-(4-chlorophenoxy)phenol (CID 18807) is 5-chloro-2-(4-chlorophenoxy)phenol.
What is the SMILES notation for 5-chloro-2-(4-chlorophenoxy)phenol?
The canonical SMILES for 5-chloro-2-(4-chlorophenoxy)phenol is Oc1cc(Cl)ccc1Oc1ccc(Cl)cc1.
What is the InChIKey of 5-chloro-2-(4-chlorophenoxy)phenol?
The InChIKey is BYNQFCJOHGOKSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8Cl2O2/c13-8-1-4-10(5-2-8)16-12-6-3-9(14)7-11(12)15/h1-7,15H.
What are the key properties of 5-chloro-2-(4-chlorophenoxy)phenol?
5-chloro-2-(4-chlorophenoxy)phenol has a molecular weight of 255.10 g/mol, XLogP of 4.49, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-(4-chlorophenoxy)phenol is sourced from PubChem (CID 18807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).