2-methoxy-1-(3-methoxy-4-methylphenyl)ethanol

C11H16O3 — CID 115819121

IUPAC2-methoxy-1-(3-methoxy-4-methylphenyl)ethanol
SMILESCOCC(O)c1ccc(C)c(OC)c1
InChIInChI=1S/C11H16O3/c1-8-4-5-9(6-11(8)14-3)10(12)7-13-2/h4-6,10,12H,7H2,1-3H3
InChIKeyBHLQQOCXRUHBIE-UHFFFAOYSA-N
MW196.25 g/mol
LogP1.68
Rot. Bonds4

About 2-methoxy-1-(3-methoxy-4-methylphenyl)ethanol

2-methoxy-1-(3-methoxy-4-methylphenyl)ethanol (PubChem CID 115819121) has the molecular formula C11H16O3 and a molecular weight of 196.25 g/mol. Its IUPAC name is 2-methoxy-1-(3-methoxy-4-methylphenyl)ethanol.

Molecular Properties

Compound Name2-methoxy-1-(3-methoxy-4-methylphenyl)ethanol
PubChem CID115819121
Molecular FormulaC11H16O3
Molecular Weight196.25 g/mol
Exact Mass196.11
IUPAC Name2-methoxy-1-(3-methoxy-4-methylphenyl)ethanol
SMILESCOCC(O)c1ccc(C)c(OC)c1
InChIInChI=1S/C11H16O3/c1-8-4-5-9(6-11(8)14-3)10(12)7-13-2/h4-6,10,12H,7H2,1-3H3
InChIKeyBHLQQOCXRUHBIE-UHFFFAOYSA-N
XLogP1.68
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-bromo-4-methylphenyl)-2-methoxyethanol
CID 115819132
2-methoxy-1-(3,4,5-trimethoxyphenyl)ethanol
CID 79566976
2-(2,5-dimethylphenyl)-1-(3-methoxy-4-methylphenyl)ethanol
CID 63018668
methyl 4-[(1R)-1-hydroxy-2-methoxyethyl]-2-methoxybenzoate
CID 135189064
2-(3-methoxy-4-methylphenyl)butan-1-ol
CID 139504441
3-amino-1-(3-methoxy-4-methylphenyl)propane-1,2-diol
CID 170827972
1-(3,4-dimethylphenyl)-4-methoxy-3-methylbutan-1-ol
CID 105091703
2-(2-bromophenyl)-1-(3-methoxy-4-methylphenyl)ethanol
CID 114977277
3-(3-methoxy-4-methylphenyl)butan-1-ol
CID 72978410
3-amino-1-(3,4-dimethoxyphenyl)-4-methoxybutan-1-ol
CID 112629915
(3,4-diethylphenyl)-(3-methoxy-4-methylphenyl)methanol
CID 115482617
(1R)-1-(3,4-dimethoxyphenyl)propan-1-ol
CID 873110

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-1-(3-methoxy-4-methylphenyl)ethanol?
The IUPAC name of 2-methoxy-1-(3-methoxy-4-methylphenyl)ethanol (CID 115819121) is 2-methoxy-1-(3-methoxy-4-methylphenyl)ethanol.
What is the SMILES notation for 2-methoxy-1-(3-methoxy-4-methylphenyl)ethanol?
The canonical SMILES for 2-methoxy-1-(3-methoxy-4-methylphenyl)ethanol is COCC(O)c1ccc(C)c(OC)c1.
What is the InChIKey of 2-methoxy-1-(3-methoxy-4-methylphenyl)ethanol?
The InChIKey is BHLQQOCXRUHBIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16O3/c1-8-4-5-9(6-11(8)14-3)10(12)7-13-2/h4-6,10,12H,7H2,1-3H3.
What are the key properties of 2-methoxy-1-(3-methoxy-4-methylphenyl)ethanol?
2-methoxy-1-(3-methoxy-4-methylphenyl)ethanol has a molecular weight of 196.25 g/mol, XLogP of 1.68, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-1-(3-methoxy-4-methylphenyl)ethanol is sourced from PubChem (CID 115819121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).