4-ethyl-2-(5-ethyl-2-hydroxyphenoxy)phenol

C16H18O3 — CID 18691745

IUPAC4-ethyl-2-(5-ethyl-2-hydroxyphenoxy)phenol
SMILESCCc1ccc(O)c(Oc2cc(CC)ccc2O)c1
InChIInChI=1S/C16H18O3/c1-3-11-5-7-13(17)15(9-11)19-16-10-12(4-2)6-8-14(16)18/h5-10,17-18H,3-4H2,1-2H3
InChIKeyYOBRLCSTXMXUKC-UHFFFAOYSA-N
MW258.32 g/mol
LogP4.01
Rot. Bonds4

About 4-ethyl-2-(5-ethyl-2-hydroxyphenoxy)phenol

4-ethyl-2-(5-ethyl-2-hydroxyphenoxy)phenol (PubChem CID 18691745) has the molecular formula C16H18O3 and a molecular weight of 258.32 g/mol. Its IUPAC name is 4-ethyl-2-(5-ethyl-2-hydroxyphenoxy)phenol.

Molecular Properties

Compound Name4-ethyl-2-(5-ethyl-2-hydroxyphenoxy)phenol
PubChem CID18691745
Molecular FormulaC16H18O3
Molecular Weight258.32 g/mol
Exact Mass258.13
IUPAC Name4-ethyl-2-(5-ethyl-2-hydroxyphenoxy)phenol
SMILESCCc1ccc(O)c(Oc2cc(CC)ccc2O)c1
InChIInChI=1S/C16H18O3/c1-3-11-5-7-13(17)15(9-11)19-16-10-12(4-2)6-8-14(16)18/h5-10,17-18H,3-4H2,1-2H3
InChIKeyYOBRLCSTXMXUKC-UHFFFAOYSA-N
XLogP4.01
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 54.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-hydroxy-5-[2-(4-hydroxyphenyl)ethyl]phenoxy]-4-[2-(4-hydroxyphenyl)ethyl]phenol
CID 172870512
4-ethyl-2-[(2-hydroxyphenyl)-methoxymethoxy]phenol
CID 91012605
2-(2,4-dichlorophenoxy)-5-ethylphenol
CID 25023958
(5-ethyl-2-hydroxyphenyl)boronic acid
CID 18617035
ethane;2-methoxy-4-propylphenol
CID 144852330
bis(2-tert-butyl-4-ethylphenol);methane
CID 174954816
4-(iodomethyl)-2-methoxyphenol
CID 15255516
4-ethyl-2-(methylideneamino)phenol
CID 118350494
4-[(4-hydroxy-3-methoxyphenyl)methoxymethyl]-2-methoxyphenol
CID 22599015
4-(fluoromethyl)-2-methoxyphenol
CID 84650348
5-ethyl-2-iodophenol
CID 22996199
2-ethoxy-4-(methylaminomethyl)phenol
CID 16776359

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2-(5-ethyl-2-hydroxyphenoxy)phenol?
The IUPAC name of 4-ethyl-2-(5-ethyl-2-hydroxyphenoxy)phenol (CID 18691745) is 4-ethyl-2-(5-ethyl-2-hydroxyphenoxy)phenol.
What is the SMILES notation for 4-ethyl-2-(5-ethyl-2-hydroxyphenoxy)phenol?
The canonical SMILES for 4-ethyl-2-(5-ethyl-2-hydroxyphenoxy)phenol is CCc1ccc(O)c(Oc2cc(CC)ccc2O)c1.
What is the InChIKey of 4-ethyl-2-(5-ethyl-2-hydroxyphenoxy)phenol?
The InChIKey is YOBRLCSTXMXUKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18O3/c1-3-11-5-7-13(17)15(9-11)19-16-10-12(4-2)6-8-14(16)18/h5-10,17-18H,3-4H2,1-2H3.
What are the key properties of 4-ethyl-2-(5-ethyl-2-hydroxyphenoxy)phenol?
4-ethyl-2-(5-ethyl-2-hydroxyphenoxy)phenol has a molecular weight of 258.32 g/mol, XLogP of 4.01, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-(5-ethyl-2-hydroxyphenoxy)phenol is sourced from PubChem (CID 18691745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).