1-(2-ethoxyphenyl)-2-methoxy-1-phenylethanol

C17H20O3 — CID 103465363

IUPAC1-(2-ethoxyphenyl)-2-methoxy-1-phenylethanol
SMILESCCOc1ccccc1C(O)(COC)c1ccccc1
InChIInChI=1S/C17H20O3/c1-3-20-16-12-8-7-11-15(16)17(18,13-19-2)14-9-5-4-6-10-14/h4-12,18H,3,13H2,1-2H3
InChIKeyGXWDDBVXPPLAGS-UHFFFAOYSA-N
MW272.34 g/mol
LogP2.97
Rot. Bonds6

About 1-(2-ethoxyphenyl)-2-methoxy-1-phenylethanol

1-(2-ethoxyphenyl)-2-methoxy-1-phenylethanol (PubChem CID 103465363) has the molecular formula C17H20O3 and a molecular weight of 272.34 g/mol. Its IUPAC name is 1-(2-ethoxyphenyl)-2-methoxy-1-phenylethanol.

Molecular Properties

Compound Name1-(2-ethoxyphenyl)-2-methoxy-1-phenylethanol
PubChem CID103465363
Molecular FormulaC17H20O3
Molecular Weight272.34 g/mol
Exact Mass272.14
IUPAC Name1-(2-ethoxyphenyl)-2-methoxy-1-phenylethanol
SMILESCCOc1ccccc1C(O)(COC)c1ccccc1
InChIInChI=1S/C17H20O3/c1-3-20-16-12-8-7-11-15(16)17(18,13-19-2)14-9-5-4-6-10-14/h4-12,18H,3,13H2,1-2H3
InChIKeyGXWDDBVXPPLAGS-UHFFFAOYSA-N
XLogP2.97
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.34
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-ethoxyphenyl)-2-methoxy-1-phenylethanol?
The IUPAC name of 1-(2-ethoxyphenyl)-2-methoxy-1-phenylethanol (CID 103465363) is 1-(2-ethoxyphenyl)-2-methoxy-1-phenylethanol.
What is the SMILES notation for 1-(2-ethoxyphenyl)-2-methoxy-1-phenylethanol?
The canonical SMILES for 1-(2-ethoxyphenyl)-2-methoxy-1-phenylethanol is CCOc1ccccc1C(O)(COC)c1ccccc1.
What is the InChIKey of 1-(2-ethoxyphenyl)-2-methoxy-1-phenylethanol?
The InChIKey is GXWDDBVXPPLAGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20O3/c1-3-20-16-12-8-7-11-15(16)17(18,13-19-2)14-9-5-4-6-10-14/h4-12,18H,3,13H2,1-2H3.
What are the key properties of 1-(2-ethoxyphenyl)-2-methoxy-1-phenylethanol?
1-(2-ethoxyphenyl)-2-methoxy-1-phenylethanol has a molecular weight of 272.34 g/mol, XLogP of 2.97, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethoxyphenyl)-2-methoxy-1-phenylethanol is sourced from PubChem (CID 103465363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).