1-(2-ethoxy-6-methoxyphenyl)ethenol

C11H14O3 — CID 142811438

IUPAC1-(2-ethoxy-6-methoxyphenyl)ethenol
SMILESC=C(O)c1c(OC)cccc1OCC
InChIInChI=1S/C11H14O3/c1-4-14-10-7-5-6-9(13-3)11(10)8(2)12/h5-7,12H,2,4H2,1,3H3
InChIKeyPWTLIOHUSLIJAG-UHFFFAOYSA-N
MW194.23 g/mol
LogP2.62
Rot. Bonds4

About 1-(2-ethoxy-6-methoxyphenyl)ethenol

1-(2-ethoxy-6-methoxyphenyl)ethenol (PubChem CID 142811438) has the molecular formula C11H14O3 and a molecular weight of 194.23 g/mol. Its IUPAC name is 1-(2-ethoxy-6-methoxyphenyl)ethenol.

Molecular Properties

Compound Name1-(2-ethoxy-6-methoxyphenyl)ethenol
PubChem CID142811438
Molecular FormulaC11H14O3
Molecular Weight194.23 g/mol
Exact Mass194.09
IUPAC Name1-(2-ethoxy-6-methoxyphenyl)ethenol
SMILESC=C(O)c1c(OC)cccc1OCC
InChIInChI=1S/C11H14O3/c1-4-14-10-7-5-6-9(13-3)11(10)8(2)12/h5-7,12H,2,4H2,1,3H3
InChIKeyPWTLIOHUSLIJAG-UHFFFAOYSA-N
XLogP2.62
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(2-ethoxy-6-methoxyphenyl)ethenol?
The IUPAC name of 1-(2-ethoxy-6-methoxyphenyl)ethenol (CID 142811438) is 1-(2-ethoxy-6-methoxyphenyl)ethenol.
What is the SMILES notation for 1-(2-ethoxy-6-methoxyphenyl)ethenol?
The canonical SMILES for 1-(2-ethoxy-6-methoxyphenyl)ethenol is C=C(O)c1c(OC)cccc1OCC.
What is the InChIKey of 1-(2-ethoxy-6-methoxyphenyl)ethenol?
The InChIKey is PWTLIOHUSLIJAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O3/c1-4-14-10-7-5-6-9(13-3)11(10)8(2)12/h5-7,12H,2,4H2,1,3H3.
What are the key properties of 1-(2-ethoxy-6-methoxyphenyl)ethenol?
1-(2-ethoxy-6-methoxyphenyl)ethenol has a molecular weight of 194.23 g/mol, XLogP of 2.62, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethoxy-6-methoxyphenyl)ethenol is sourced from PubChem (CID 142811438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).