1-(3-ethoxy-5-methylphenyl)ethanol

C11H16O2 — CID 171367862

IUPAC1-(3-ethoxy-5-methylphenyl)ethanol
SMILESCCOc1cc(C)cc(C(C)O)c1
InChIInChI=1S/C11H16O2/c1-4-13-11-6-8(2)5-10(7-11)9(3)12/h5-7,9,12H,4H2,1-3H3
InChIKeyAUUWXWLAGWHGMF-UHFFFAOYSA-N
MW180.25 g/mol
LogP2.45
Rot. Bonds3

About 1-(3-ethoxy-5-methylphenyl)ethanol

1-(3-ethoxy-5-methylphenyl)ethanol (PubChem CID 171367862) has the molecular formula C11H16O2 and a molecular weight of 180.25 g/mol. Its IUPAC name is 1-(3-ethoxy-5-methylphenyl)ethanol.

Molecular Properties

Compound Name1-(3-ethoxy-5-methylphenyl)ethanol
PubChem CID171367862
Molecular FormulaC11H16O2
Molecular Weight180.25 g/mol
Exact Mass180.12
IUPAC Name1-(3-ethoxy-5-methylphenyl)ethanol
SMILESCCOc1cc(C)cc(C(C)O)c1
InChIInChI=1S/C11H16O2/c1-4-13-11-6-8(2)5-10(7-11)9(3)12/h5-7,9,12H,4H2,1-3H3
InChIKeyAUUWXWLAGWHGMF-UHFFFAOYSA-N
XLogP2.45
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3,5-diethoxyphenyl)-2-methylpropan-1-ol
CID 70065234
(1S)-1-(4-ethoxy-3,5-dimethylphenyl)ethanol
CID 97294345
1-[3-(3,5-dimethyl-1,2-oxazol-4-yl)-5-ethoxyphenyl]ethanol
CID 54669868
[3-(1-hydroxyethyl)-5-methylphenyl] N-methylcarbamate
CID 154515716
1-(3,5-ditert-butyl-4-ethoxyphenyl)ethanol
CID 82265791
3-ethoxy-5-methylaniline
CID 67863452
1-(5-ethoxy-2-fluoro-3-methylphenyl)ethanol
CID 164891517
1-(3-methyl-5-propan-2-ylphenoxy)pentan-2-one
CID 62044718
1-(3-bromo-5-methylphenyl)ethanol
CID 84680750
1-(2,2-dimethylpropoxy)-3-ethoxy-5-methylbenzene
CID 170603030
1-(3-fluoro-5-pentoxyphenyl)ethanol
CID 91657933
1-(4-diazenyl-3,5-diethoxyphenyl)ethanol
CID 71072786

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethoxy-5-methylphenyl)ethanol?
The IUPAC name of 1-(3-ethoxy-5-methylphenyl)ethanol (CID 171367862) is 1-(3-ethoxy-5-methylphenyl)ethanol.
What is the SMILES notation for 1-(3-ethoxy-5-methylphenyl)ethanol?
The canonical SMILES for 1-(3-ethoxy-5-methylphenyl)ethanol is CCOc1cc(C)cc(C(C)O)c1.
What is the InChIKey of 1-(3-ethoxy-5-methylphenyl)ethanol?
The InChIKey is AUUWXWLAGWHGMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16O2/c1-4-13-11-6-8(2)5-10(7-11)9(3)12/h5-7,9,12H,4H2,1-3H3.
What are the key properties of 1-(3-ethoxy-5-methylphenyl)ethanol?
1-(3-ethoxy-5-methylphenyl)ethanol has a molecular weight of 180.25 g/mol, XLogP of 2.45, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethoxy-5-methylphenyl)ethanol is sourced from PubChem (CID 171367862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).