1-(3,4-dimethoxyphenyl)-1-(2-methoxyphenyl)ethanol

C17H20O4 — CID 62788494

IUPAC1-(3,4-dimethoxyphenyl)-1-(2-methoxyphenyl)ethanol
SMILESCOc1ccc(C(C)(O)c2ccccc2OC)cc1OC
InChIInChI=1S/C17H20O4/c1-17(18,13-7-5-6-8-14(13)19-2)12-9-10-15(20-3)16(11-12)21-4/h5-11,18H,1-4H3
InChIKeyCGSDFMVRVJPJFS-UHFFFAOYSA-N
MW288.34 g/mol
LogP2.97
Rot. Bonds5

About 1-(3,4-dimethoxyphenyl)-1-(2-methoxyphenyl)ethanol

1-(3,4-dimethoxyphenyl)-1-(2-methoxyphenyl)ethanol (PubChem CID 62788494) has the molecular formula C17H20O4 and a molecular weight of 288.34 g/mol. Its IUPAC name is 1-(3,4-dimethoxyphenyl)-1-(2-methoxyphenyl)ethanol.

Molecular Properties

Compound Name1-(3,4-dimethoxyphenyl)-1-(2-methoxyphenyl)ethanol
PubChem CID62788494
Molecular FormulaC17H20O4
Molecular Weight288.34 g/mol
Exact Mass288.14
IUPAC Name1-(3,4-dimethoxyphenyl)-1-(2-methoxyphenyl)ethanol
SMILESCOc1ccc(C(C)(O)c2ccccc2OC)cc1OC
InChIInChI=1S/C17H20O4/c1-17(18,13-7-5-6-8-14(13)19-2)12-9-10-15(20-3)16(11-12)21-4/h5-11,18H,1-4H3
InChIKeyCGSDFMVRVJPJFS-UHFFFAOYSA-N
XLogP2.97
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.34
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-tert-butylphenyl)-1-(2-methoxyphenyl)ethanol
CID 62549935
1-(3,4-dimethoxyphenyl)-1-phenylethanol
CID 55116125
1-(4-fluorophenyl)-1-(2-methoxyphenyl)ethanol
CID 60793238
1-(3,4-dimethoxyphenyl)-1-isoquinolin-4-ylethanol
CID 134913621
1-(3,4-dimethoxyphenyl)-1-(3-methoxyphenyl)ethanol
CID 62787623
1-(2,6-dimethoxyphenyl)-1-(2-methoxyphenyl)ethanol
CID 116809641
2-(3,4-dimethoxyphenyl)-3,3-dimethylbutan-2-ol
CID 113302772
1-(2-methoxyphenyl)-1-thiophen-3-ylethanol
CID 65099719
1-(3,4-dimethoxyphenyl)-1-(3-fluorophenyl)ethanol
CID 62787268
2-(2-methoxyphenyl)-3,3-dimethylbutan-2-ol
CID 591994
1-(2-methoxyphenyl)-1-quinolin-3-ylethanol
CID 60924956
3-(2-methoxyphenyl)-2,2,4,4-tetramethylpentan-3-ol
CID 606344

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-dimethoxyphenyl)-1-(2-methoxyphenyl)ethanol?
The IUPAC name of 1-(3,4-dimethoxyphenyl)-1-(2-methoxyphenyl)ethanol (CID 62788494) is 1-(3,4-dimethoxyphenyl)-1-(2-methoxyphenyl)ethanol.
What is the SMILES notation for 1-(3,4-dimethoxyphenyl)-1-(2-methoxyphenyl)ethanol?
The canonical SMILES for 1-(3,4-dimethoxyphenyl)-1-(2-methoxyphenyl)ethanol is COc1ccc(C(C)(O)c2ccccc2OC)cc1OC.
What is the InChIKey of 1-(3,4-dimethoxyphenyl)-1-(2-methoxyphenyl)ethanol?
The InChIKey is CGSDFMVRVJPJFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20O4/c1-17(18,13-7-5-6-8-14(13)19-2)12-9-10-15(20-3)16(11-12)21-4/h5-11,18H,1-4H3.
What are the key properties of 1-(3,4-dimethoxyphenyl)-1-(2-methoxyphenyl)ethanol?
1-(3,4-dimethoxyphenyl)-1-(2-methoxyphenyl)ethanol has a molecular weight of 288.34 g/mol, XLogP of 2.97, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,4-dimethoxyphenyl)-1-(2-methoxyphenyl)ethanol is sourced from PubChem (CID 62788494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).