2-(2,4-dichlorophenoxy)-5-phenylphenol

C18H12Cl2O2 — CID 25023954

IUPAC2-(2,4-dichlorophenoxy)-5-phenylphenol
SMILESOc1cc(-c2ccccc2)ccc1Oc1ccc(Cl)cc1Cl
InChIInChI=1S/C18H12Cl2O2/c19-14-7-9-17(15(20)11-14)22-18-8-6-13(10-16(18)21)12-4-2-1-3-5-12/h1-11,21H
InChIKeyNOKHJANPMHROFU-UHFFFAOYSA-N
MW331.20 g/mol
LogP6.16
Rot. Bonds3

About 2-(2,4-dichlorophenoxy)-5-phenylphenol

2-(2,4-dichlorophenoxy)-5-phenylphenol (PubChem CID 25023954) has the molecular formula C18H12Cl2O2 and a molecular weight of 331.20 g/mol. Its IUPAC name is 2-(2,4-dichlorophenoxy)-5-phenylphenol.

Molecular Properties

Compound Name2-(2,4-dichlorophenoxy)-5-phenylphenol
PubChem CID25023954
Molecular FormulaC18H12Cl2O2
Molecular Weight331.20 g/mol
Exact Mass330.02
IUPAC Name2-(2,4-dichlorophenoxy)-5-phenylphenol
SMILESOc1cc(-c2ccccc2)ccc1Oc1ccc(Cl)cc1Cl
InChIInChI=1S/C18H12Cl2O2/c19-14-7-9-17(15(20)11-14)22-18-8-6-13(10-16(18)21)12-4-2-1-3-5-12/h1-11,21H
InChIKeyNOKHJANPMHROFU-UHFFFAOYSA-N
XLogP6.16
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500331.20
LogP ≤ 56.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,4-Dichlorophenoxy)-5-(hydroxymethyl)phenol
CID 23656595
2-(2-Chloranylphenoxy)-5-Hexyl-Phenol
CID 86302364
2-(2,4-Dichlorophenoxy)-5-methylphenol
CID 22947105
5-(Chloromethyl)-2-(2,4-dichlorophenoxy)phenol
CID 23656591
4-(2,4-Dichlorophenoxy)-3-hydroxybenzonitrile
CID 25023955
2-(2,4-Dichlorophenoxy)-5-ethylphenol
CID 25023958
2-(2,4-Dichlorophenoxy)-5-(4-fluorophenyl)phenol
CID 25023968
2-(2-Chlorophenoxy)-5-ethyl-4-fluorophenol
CID 126961630
2-(2-Chlorophenoxy)-4-fluoro-5-hexylphenol
CID 126961635
Ambigol A
CID 475341
4-(2,4-Dichlorophenoxy)-2'-Methylbiphenyl-3-Ol
CID 15942656
2-(2,4-Dichlorophenoxy)-5-(3-phenylpropyl)phenol
CID 16220126

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenoxy)-5-phenylphenol?
The IUPAC name of 2-(2,4-dichlorophenoxy)-5-phenylphenol (CID 25023954) is 2-(2,4-dichlorophenoxy)-5-phenylphenol.
What is the SMILES notation for 2-(2,4-dichlorophenoxy)-5-phenylphenol?
The canonical SMILES for 2-(2,4-dichlorophenoxy)-5-phenylphenol is Oc1cc(-c2ccccc2)ccc1Oc1ccc(Cl)cc1Cl.
What is the InChIKey of 2-(2,4-dichlorophenoxy)-5-phenylphenol?
The InChIKey is NOKHJANPMHROFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12Cl2O2/c19-14-7-9-17(15(20)11-14)22-18-8-6-13(10-16(18)21)12-4-2-1-3-5-12/h1-11,21H.
What are the key properties of 2-(2,4-dichlorophenoxy)-5-phenylphenol?
2-(2,4-dichlorophenoxy)-5-phenylphenol has a molecular weight of 331.20 g/mol, XLogP of 6.16, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenoxy)-5-phenylphenol is sourced from PubChem (CID 25023954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).