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

C18H22O3 — CID 62537327

IUPAC1-(2,4-dimethoxyphenyl)-2-(3,4-dimethylphenyl)ethanol
SMILESCOc1ccc(C(O)Cc2ccc(C)c(C)c2)c(OC)c1
InChIInChI=1S/C18H22O3/c1-12-5-6-14(9-13(12)2)10-17(19)16-8-7-15(20-3)11-18(16)21-4/h5-9,11,17,19H,10H2,1-4H3
InChIKeyPVLNGLWAOMBMTC-UHFFFAOYSA-N
MW286.37 g/mol
LogP3.60
Rot. Bonds5

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

1-(2,4-dimethoxyphenyl)-2-(3,4-dimethylphenyl)ethanol (PubChem CID 62537327) has the molecular formula C18H22O3 and a molecular weight of 286.37 g/mol. Its IUPAC name is 1-(2,4-dimethoxyphenyl)-2-(3,4-dimethylphenyl)ethanol.

Molecular Properties

Compound Name1-(2,4-dimethoxyphenyl)-2-(3,4-dimethylphenyl)ethanol
PubChem CID62537327
Molecular FormulaC18H22O3
Molecular Weight286.37 g/mol
Exact Mass286.16
IUPAC Name1-(2,4-dimethoxyphenyl)-2-(3,4-dimethylphenyl)ethanol
SMILESCOc1ccc(C(O)Cc2ccc(C)c(C)c2)c(OC)c1
InChIInChI=1S/C18H22O3/c1-12-5-6-14(9-13(12)2)10-17(19)16-8-7-15(20-3)11-18(16)21-4/h5-9,11,17,19H,10H2,1-4H3
InChIKeyPVLNGLWAOMBMTC-UHFFFAOYSA-N
XLogP3.60
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 ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[1-bromo-2-(3,4-dimethylphenyl)ethyl]-2,4-dimethoxybenzene
CID 63441842
1-(4-bromo-2-methoxyphenyl)-2-(3,4-dimethylphenyl)ethanol
CID 115370058
1-(4-chloro-2-methoxyphenyl)-2-(3,4-dimethylphenyl)ethanol
CID 63018032
(1S)-1-[2-[(3,4-dimethylphenyl)methoxy]-4-methoxyphenyl]ethanol
CID 82003422
(4R)-4-(2,4-dimethoxyphenyl)-4-hydroxybutan-2-one
CID 131874680
1-(5-bromo-2-methoxy-4-methylphenyl)-2-(4-methoxyphenyl)ethanol
CID 65434522
3-(2,4-dimethoxyphenyl)-3-hydroxypropanenitrile
CID 5163746
1-(2,4-dimethoxyphenyl)-4-methylpentan-1-ol
CID 61088835
1-(2,4-dimethoxyphenyl)-3-methylbut-3-en-1-ol
CID 115816972
1-(2-bromo-5-methoxyphenyl)-2-(3,4-dimethylphenyl)ethanamine
CID 62538802
1-(2,4-dimethoxyphenyl)-2-propan-2-ylsulfanylethanol
CID 65131405
4-amino-1-(2,4-dimethoxyphenyl)butan-1-ol
CID 112507580

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dimethoxyphenyl)-2-(3,4-dimethylphenyl)ethanol?
The IUPAC name of 1-(2,4-dimethoxyphenyl)-2-(3,4-dimethylphenyl)ethanol (CID 62537327) is 1-(2,4-dimethoxyphenyl)-2-(3,4-dimethylphenyl)ethanol.
What is the SMILES notation for 1-(2,4-dimethoxyphenyl)-2-(3,4-dimethylphenyl)ethanol?
The canonical SMILES for 1-(2,4-dimethoxyphenyl)-2-(3,4-dimethylphenyl)ethanol is COc1ccc(C(O)Cc2ccc(C)c(C)c2)c(OC)c1.
What is the InChIKey of 1-(2,4-dimethoxyphenyl)-2-(3,4-dimethylphenyl)ethanol?
The InChIKey is PVLNGLWAOMBMTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22O3/c1-12-5-6-14(9-13(12)2)10-17(19)16-8-7-15(20-3)11-18(16)21-4/h5-9,11,17,19H,10H2,1-4H3.
What are the key properties of 1-(2,4-dimethoxyphenyl)-2-(3,4-dimethylphenyl)ethanol?
1-(2,4-dimethoxyphenyl)-2-(3,4-dimethylphenyl)ethanol has a molecular weight of 286.37 g/mol, XLogP of 3.60, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dimethoxyphenyl)-2-(3,4-dimethylphenyl)ethanol is sourced from PubChem (CID 62537327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).