4-[1-hydroxy-2-(4-methoxyphenoxy)ethyl]phenol

C15H16O4 — CID 117244685

IUPAC4-[1-hydroxy-2-(4-methoxyphenoxy)ethyl]phenol
SMILESCOc1ccc(OCC(O)c2ccc(O)cc2)cc1
InChIInChI=1S/C15H16O4/c1-18-13-6-8-14(9-7-13)19-10-15(17)11-2-4-12(16)5-3-11/h2-9,15-17H,10H2,1H3
InChIKeyNJDJJIBISPPQJX-UHFFFAOYSA-N
MW260.29 g/mol
LogP2.51
Rot. Bonds5

About 4-[1-hydroxy-2-(4-methoxyphenoxy)ethyl]phenol

4-[1-hydroxy-2-(4-methoxyphenoxy)ethyl]phenol (PubChem CID 117244685) has the molecular formula C15H16O4 and a molecular weight of 260.29 g/mol. Its IUPAC name is 4-[1-hydroxy-2-(4-methoxyphenoxy)ethyl]phenol.

Molecular Properties

Compound Name4-[1-hydroxy-2-(4-methoxyphenoxy)ethyl]phenol
PubChem CID117244685
Molecular FormulaC15H16O4
Molecular Weight260.29 g/mol
Exact Mass260.10
IUPAC Name4-[1-hydroxy-2-(4-methoxyphenoxy)ethyl]phenol
SMILESCOc1ccc(OCC(O)c2ccc(O)cc2)cc1
InChIInChI=1S/C15H16O4/c1-18-13-6-8-14(9-7-13)19-10-15(17)11-2-4-12(16)5-3-11/h2-9,15-17H,10H2,1H3
InChIKeyNJDJJIBISPPQJX-UHFFFAOYSA-N
XLogP2.51
TPSA58.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.29
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3,5-difluorophenoxy)-1-(4-methoxyphenyl)ethanol
CID 62783768
methyl 3-(4-hydroxyphenoxy)-2-(4-methoxyphenyl)propanoate
CID 117245315
1-(4-methoxyphenyl)(213C)ethane-1,2-diol
CID 101170566
2-(2-chlorophenoxy)-1-(4-methoxyphenyl)ethanol
CID 117244582
4-[(3S,4R)-4-(4-methoxyphenyl)hexan-3-yl]phenol
CID 11954178
[2-hydroxy-2-(4-methoxyphenyl)ethyl] acetate
CID 13275342
2-(4-aminophenoxy)-1-(4-propan-2-ylphenyl)ethanol
CID 46307232
methane;4-methoxyphenol
CID 159494332
2-chloro-1-(4-methoxyphenyl)ethanol
CID 12862876
4-[2-(4-cyanophenoxy)-1-hydroxyethyl]benzonitrile
CID 109412889
2-(2-ethylbutoxy)-1-(4-methoxyphenyl)ethanol
CID 114208512
7-(4-hydroxyphenyl)-1-(4-methoxyphenyl)heptane-1,5-diol
CID 165355377

Frequently Asked Questions

What is the IUPAC name of 4-[1-hydroxy-2-(4-methoxyphenoxy)ethyl]phenol?
The IUPAC name of 4-[1-hydroxy-2-(4-methoxyphenoxy)ethyl]phenol (CID 117244685) is 4-[1-hydroxy-2-(4-methoxyphenoxy)ethyl]phenol.
What is the SMILES notation for 4-[1-hydroxy-2-(4-methoxyphenoxy)ethyl]phenol?
The canonical SMILES for 4-[1-hydroxy-2-(4-methoxyphenoxy)ethyl]phenol is COc1ccc(OCC(O)c2ccc(O)cc2)cc1.
What is the InChIKey of 4-[1-hydroxy-2-(4-methoxyphenoxy)ethyl]phenol?
The InChIKey is NJDJJIBISPPQJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O4/c1-18-13-6-8-14(9-7-13)19-10-15(17)11-2-4-12(16)5-3-11/h2-9,15-17H,10H2,1H3.
What are the key properties of 4-[1-hydroxy-2-(4-methoxyphenoxy)ethyl]phenol?
4-[1-hydroxy-2-(4-methoxyphenoxy)ethyl]phenol has a molecular weight of 260.29 g/mol, XLogP of 2.51, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-hydroxy-2-(4-methoxyphenoxy)ethyl]phenol is sourced from PubChem (CID 117244685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).