2-[2-(2-hydroxyphenoxy)ethoxy]phenol

C14H14O4 — CID 5171332

IUPAC2-[2-(2-hydroxyphenoxy)ethoxy]phenol
SMILESOc1ccccc1OCCOc1ccccc1O
InChIInChI=1S/C14H14O4/c15-11-5-1-3-7-13(11)17-9-10-18-14-8-4-2-6-12(14)16/h1-8,15-16H,9-10H2
InChIKeyPRYNAEBLJBDWPF-UHFFFAOYSA-N
MW246.26 g/mol
LogP2.56
Rot. Bonds5

About 2-[2-(2-hydroxyphenoxy)ethoxy]phenol

2-[2-(2-hydroxyphenoxy)ethoxy]phenol (PubChem CID 5171332) has the molecular formula C14H14O4 and a molecular weight of 246.26 g/mol. Its IUPAC name is 2-[2-(2-hydroxyphenoxy)ethoxy]phenol.

Molecular Properties

Compound Name2-[2-(2-hydroxyphenoxy)ethoxy]phenol
PubChem CID5171332
Molecular FormulaC14H14O4
Molecular Weight246.26 g/mol
Exact Mass246.09
IUPAC Name2-[2-(2-hydroxyphenoxy)ethoxy]phenol
SMILESOc1ccccc1OCCOc1ccccc1O
InChIInChI=1S/C14H14O4/c15-11-5-1-3-7-13(11)17-9-10-18-14-8-4-2-6-12(14)16/h1-8,15-16H,9-10H2
InChIKeyPRYNAEBLJBDWPF-UHFFFAOYSA-N
XLogP2.56
TPSA58.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.26
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

Phenoxyethanol
CID 31236
Guaiacol
CID 460
Guaifenesin
CID 3516
4-Phenoxyphenol
CID 13254
2-Ethoxyphenol
CID 66755
Dibenzo-P-dioxin
CID 9216
4,4'-Dihydroxydiphenyl ether
CID 16069
1,2-Diphenoxyethane
CID 7713
2,2'-(p-Phenylenedioxy)diethanol
CID 66912
2-Phenoxy-1-propanol
CID 20129
2-(2-Phenoxyethoxy)ethanol
CID 7715
1-Ethoxy-2-methoxybenzene
CID 87170

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-hydroxyphenoxy)ethoxy]phenol?
The IUPAC name of 2-[2-(2-hydroxyphenoxy)ethoxy]phenol (CID 5171332) is 2-[2-(2-hydroxyphenoxy)ethoxy]phenol.
What is the SMILES notation for 2-[2-(2-hydroxyphenoxy)ethoxy]phenol?
The canonical SMILES for 2-[2-(2-hydroxyphenoxy)ethoxy]phenol is Oc1ccccc1OCCOc1ccccc1O.
What is the InChIKey of 2-[2-(2-hydroxyphenoxy)ethoxy]phenol?
The InChIKey is PRYNAEBLJBDWPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14O4/c15-11-5-1-3-7-13(11)17-9-10-18-14-8-4-2-6-12(14)16/h1-8,15-16H,9-10H2.
What are the key properties of 2-[2-(2-hydroxyphenoxy)ethoxy]phenol?
2-[2-(2-hydroxyphenoxy)ethoxy]phenol has a molecular weight of 246.26 g/mol, XLogP of 2.56, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-hydroxyphenoxy)ethoxy]phenol is sourced from PubChem (CID 5171332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).