2-methoxy-1-(2-methoxy-4,6-dimethylphenyl)-2-phenylethanol

C18H22O3 — CID 106680320

IUPAC2-methoxy-1-(2-methoxy-4,6-dimethylphenyl)-2-phenylethanol
SMILESCOc1cc(C)cc(C)c1C(O)C(OC)c1ccccc1
InChIInChI=1S/C18H22O3/c1-12-10-13(2)16(15(11-12)20-3)17(19)18(21-4)14-8-6-5-7-9-14/h5-11,17-19H,1-4H3
InChIKeyZWMYYHKNYMACLD-UHFFFAOYSA-N
MW286.37 g/mol
LogP3.73
Rot. Bonds5

About 2-methoxy-1-(2-methoxy-4,6-dimethylphenyl)-2-phenylethanol

2-methoxy-1-(2-methoxy-4,6-dimethylphenyl)-2-phenylethanol (PubChem CID 106680320) has the molecular formula C18H22O3 and a molecular weight of 286.37 g/mol. Its IUPAC name is 2-methoxy-1-(2-methoxy-4,6-dimethylphenyl)-2-phenylethanol.

Molecular Properties

Compound Name2-methoxy-1-(2-methoxy-4,6-dimethylphenyl)-2-phenylethanol
PubChem CID106680320
Molecular FormulaC18H22O3
Molecular Weight286.37 g/mol
Exact Mass286.16
IUPAC Name2-methoxy-1-(2-methoxy-4,6-dimethylphenyl)-2-phenylethanol
SMILESCOc1cc(C)cc(C)c1C(O)C(OC)c1ccccc1
InChIInChI=1S/C18H22O3/c1-12-10-13(2)16(15(11-12)20-3)17(19)18(21-4)14-8-6-5-7-9-14/h5-11,17-19H,1-4H3
InChIKeyZWMYYHKNYMACLD-UHFFFAOYSA-N
XLogP3.73
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.37
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-fluoro-4,6-dimethylphenyl)-2-methoxy-2-phenylethanol
CID 106881196
(2,6-dimethoxy-4-methylphenyl)-phenylmethanol
CID 101134795
1-(2,4-dimethylphenyl)-2-methoxy-2-phenylethanol
CID 116756761
[(2-methoxy-4,6-dimethylphenyl)-phenylmethyl]hydrazine
CID 106682684
1-(2-methoxy-4,6-dimethylphenyl)-2-phenylsulfanylethanol
CID 106680203
1-(2-methoxy-4,6-dimethylphenyl)-2,3-dimethylbutan-1-ol
CID 106682562
1-(3-fluoro-5-methylphenyl)-2-methoxy-2-phenylethanol
CID 116756883
(3-bromophenyl)-(2-methoxy-4,6-dimethylphenyl)methanol
CID 106679553
(2-methoxy-4,6-dimethylphenyl)-(3-methylphenyl)methanamine
CID 106680388
3-(3,5-dimethylphenyl)-1-methoxy-1-phenylpropan-2-ol
CID 116757000
2-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-2-phenylethanol
CID 103433262
(3-bromo-4-methylphenyl)-(2-methoxy-4,6-dimethylphenyl)methanol
CID 106679797

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-1-(2-methoxy-4,6-dimethylphenyl)-2-phenylethanol?
The IUPAC name of 2-methoxy-1-(2-methoxy-4,6-dimethylphenyl)-2-phenylethanol (CID 106680320) is 2-methoxy-1-(2-methoxy-4,6-dimethylphenyl)-2-phenylethanol.
What is the SMILES notation for 2-methoxy-1-(2-methoxy-4,6-dimethylphenyl)-2-phenylethanol?
The canonical SMILES for 2-methoxy-1-(2-methoxy-4,6-dimethylphenyl)-2-phenylethanol is COc1cc(C)cc(C)c1C(O)C(OC)c1ccccc1.
What is the InChIKey of 2-methoxy-1-(2-methoxy-4,6-dimethylphenyl)-2-phenylethanol?
The InChIKey is ZWMYYHKNYMACLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22O3/c1-12-10-13(2)16(15(11-12)20-3)17(19)18(21-4)14-8-6-5-7-9-14/h5-11,17-19H,1-4H3.
What are the key properties of 2-methoxy-1-(2-methoxy-4,6-dimethylphenyl)-2-phenylethanol?
2-methoxy-1-(2-methoxy-4,6-dimethylphenyl)-2-phenylethanol has a molecular weight of 286.37 g/mol, XLogP of 3.73, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-1-(2-methoxy-4,6-dimethylphenyl)-2-phenylethanol is sourced from PubChem (CID 106680320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).