1-(2,6-dimethoxyphenyl)-1-(2-methoxyphenyl)ethanol

C17H20O4 — CID 116809641

IUPAC1-(2,6-dimethoxyphenyl)-1-(2-methoxyphenyl)ethanol
SMILESCOc1ccccc1C(C)(O)c1c(OC)cccc1OC
InChIInChI=1S/C17H20O4/c1-17(18,12-8-5-6-9-13(12)19-2)16-14(20-3)10-7-11-15(16)21-4/h5-11,18H,1-4H3
InChIKeyJIPZNFMYVOEZSF-UHFFFAOYSA-N
MW288.34 g/mol
LogP2.97
Rot. Bonds5

About 1-(2,6-dimethoxyphenyl)-1-(2-methoxyphenyl)ethanol

1-(2,6-dimethoxyphenyl)-1-(2-methoxyphenyl)ethanol (PubChem CID 116809641) has the molecular formula C17H20O4 and a molecular weight of 288.34 g/mol. Its IUPAC name is 1-(2,6-dimethoxyphenyl)-1-(2-methoxyphenyl)ethanol.

Molecular Properties

Compound Name1-(2,6-dimethoxyphenyl)-1-(2-methoxyphenyl)ethanol
PubChem CID116809641
Molecular FormulaC17H20O4
Molecular Weight288.34 g/mol
Exact Mass288.14
IUPAC Name1-(2,6-dimethoxyphenyl)-1-(2-methoxyphenyl)ethanol
SMILESCOc1ccccc1C(C)(O)c1c(OC)cccc1OC
InChIInChI=1S/C17H20O4/c1-17(18,12-8-5-6-9-13(12)19-2)16-14(20-3)10-7-11-15(16)21-4/h5-11,18H,1-4H3
InChIKeyJIPZNFMYVOEZSF-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
2-(2-methoxyphenyl)-3,3-dimethylbutan-2-ol
CID 591994
1-(4-fluorophenyl)-1-(2-methoxyphenyl)ethanol
CID 60793238
3-(2-methoxyphenyl)-2,2,4,4-tetramethylpentan-3-ol
CID 606344
1-(3,4-dimethoxyphenyl)-1-(2-methoxyphenyl)ethanol
CID 62788494
1-(2-fluoro-4,6-dimethylphenyl)-1-(2-methoxyphenyl)ethanol
CID 106880255
1,1-bis(2,3-dimethoxyphenyl)ethanol
CID 126607821
(2S)-2-(2-methoxyphenyl)butan-2-ol
CID 93303591
1-(5-bromo-2-fluorophenyl)-1-(2-methoxyphenyl)ethanol
CID 79743336
1-(2-methoxyphenyl)-1-thiophen-3-ylethanol
CID 65099719
1-(2-methoxyphenyl)-1-quinolin-5-ylethanol
CID 81198597
(2R)-2-(2-methoxyphenyl)but-3-en-2-ol
CID 124509510

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-dimethoxyphenyl)-1-(2-methoxyphenyl)ethanol?
The IUPAC name of 1-(2,6-dimethoxyphenyl)-1-(2-methoxyphenyl)ethanol (CID 116809641) is 1-(2,6-dimethoxyphenyl)-1-(2-methoxyphenyl)ethanol.
What is the SMILES notation for 1-(2,6-dimethoxyphenyl)-1-(2-methoxyphenyl)ethanol?
The canonical SMILES for 1-(2,6-dimethoxyphenyl)-1-(2-methoxyphenyl)ethanol is COc1ccccc1C(C)(O)c1c(OC)cccc1OC.
What is the InChIKey of 1-(2,6-dimethoxyphenyl)-1-(2-methoxyphenyl)ethanol?
The InChIKey is JIPZNFMYVOEZSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20O4/c1-17(18,12-8-5-6-9-13(12)19-2)16-14(20-3)10-7-11-15(16)21-4/h5-11,18H,1-4H3.
What are the key properties of 1-(2,6-dimethoxyphenyl)-1-(2-methoxyphenyl)ethanol?
1-(2,6-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-(2,6-dimethoxyphenyl)-1-(2-methoxyphenyl)ethanol is sourced from PubChem (CID 116809641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).