2-(ethoxymethyl)-4-[(4-hydroxyphenyl)methyl]phenol

C16H18O3 — CID 155543166

IUPAC2-(ethoxymethyl)-4-[(4-hydroxyphenyl)methyl]phenol
SMILESCCOCc1cc(Cc2ccc(O)cc2)ccc1O
InChIInChI=1S/C16H18O3/c1-2-19-11-14-10-13(5-8-16(14)18)9-12-3-6-15(17)7-4-12/h3-8,10,17-18H,2,9,11H2,1H3
InChIKeyATOFEDLNVOAKTJ-UHFFFAOYSA-N
MW258.32 g/mol
LogP3.23
Rot. Bonds5

About 2-(ethoxymethyl)-4-[(4-hydroxyphenyl)methyl]phenol

2-(ethoxymethyl)-4-[(4-hydroxyphenyl)methyl]phenol (PubChem CID 155543166) has the molecular formula C16H18O3 and a molecular weight of 258.32 g/mol. Its IUPAC name is 2-(ethoxymethyl)-4-[(4-hydroxyphenyl)methyl]phenol.

Molecular Properties

Compound Name2-(ethoxymethyl)-4-[(4-hydroxyphenyl)methyl]phenol
PubChem CID155543166
Molecular FormulaC16H18O3
Molecular Weight258.32 g/mol
Exact Mass258.13
IUPAC Name2-(ethoxymethyl)-4-[(4-hydroxyphenyl)methyl]phenol
SMILESCCOCc1cc(Cc2ccc(O)cc2)ccc1O
InChIInChI=1S/C16H18O3/c1-2-19-11-14-10-13(5-8-16(14)18)9-12-3-6-15(17)7-4-12/h3-8,10,17-18H,2,9,11H2,1H3
InChIKeyATOFEDLNVOAKTJ-UHFFFAOYSA-N
XLogP3.23
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 53.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3,4-bis(ethoxymethyl)phenol
CID 175162905
4-[(4-hydroxyphenyl)methyl]phenol
CID 12111
2-butyl-4-[(3-butyl-4-hydroxyphenyl)methyl]phenol
CID 121386327
2-[[ethyl(methyl)amino]methyl]-4-[[3-[[ethyl(methyl)amino]methyl]-4-hydroxyphenyl]methyl]phenol
CID 163931349
4-[[4-hydroxy-3-(2-methylpropyl)phenyl]methyl]-2-(2-methylpropyl)phenol
CID 22003355
2-[2-(ethoxymethyl)-4-hydroxyphenyl]acetic acid
CID 141078685
2-(2-diethoxyphosphorylethyl)-4-[(4-ethylphenyl)methyl]phenol
CID 86620240
3-bromo-4-(ethoxymethyl)phenol
CID 117219830
ethane;1-[2-hydroxy-5-[(4-hydroxyphenyl)methyl]phenyl]ethanone
CID 90829801
2-(2-diethylphosphanylethyl)-4-[(4-ethylphenyl)methyl]phenol
CID 174539786
4-[[4-(1-ethoxyethoxy)phenyl]methyl]phenol
CID 23546598
4-(ethoxymethyl)naphthalen-1-ol
CID 90487839

Frequently Asked Questions

What is the IUPAC name of 2-(ethoxymethyl)-4-[(4-hydroxyphenyl)methyl]phenol?
The IUPAC name of 2-(ethoxymethyl)-4-[(4-hydroxyphenyl)methyl]phenol (CID 155543166) is 2-(ethoxymethyl)-4-[(4-hydroxyphenyl)methyl]phenol.
What is the SMILES notation for 2-(ethoxymethyl)-4-[(4-hydroxyphenyl)methyl]phenol?
The canonical SMILES for 2-(ethoxymethyl)-4-[(4-hydroxyphenyl)methyl]phenol is CCOCc1cc(Cc2ccc(O)cc2)ccc1O.
What is the InChIKey of 2-(ethoxymethyl)-4-[(4-hydroxyphenyl)methyl]phenol?
The InChIKey is ATOFEDLNVOAKTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18O3/c1-2-19-11-14-10-13(5-8-16(14)18)9-12-3-6-15(17)7-4-12/h3-8,10,17-18H,2,9,11H2,1H3.
What are the key properties of 2-(ethoxymethyl)-4-[(4-hydroxyphenyl)methyl]phenol?
2-(ethoxymethyl)-4-[(4-hydroxyphenyl)methyl]phenol has a molecular weight of 258.32 g/mol, XLogP of 3.23, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethoxymethyl)-4-[(4-hydroxyphenyl)methyl]phenol is sourced from PubChem (CID 155543166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).