4-[(E)-3-hydroxyprop-1-enyl]-2,6-dimethoxyphenol

C11H14O4 — CID 5280507

IUPAC4-[(E)-3-hydroxyprop-1-enyl]-2,6-dimethoxyphenol
SMILESCOc1cc(/C=C/CO)cc(OC)c1O
InChIInChI=1S/C11H14O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-4,6-7,12-13H,5H2,1-2H3/b4-3+
InChIKeyLZFOPEXOUVTGJS-ONEGZZNKSA-N
MW210.23 g/mol
LogP1.41
Rot. Bonds4

About 4-[(E)-3-hydroxyprop-1-enyl]-2,6-dimethoxyphenol

4-[(E)-3-hydroxyprop-1-enyl]-2,6-dimethoxyphenol (PubChem CID 5280507) has the molecular formula C11H14O4 and a molecular weight of 210.23 g/mol. Its IUPAC name is 4-[(E)-3-hydroxyprop-1-enyl]-2,6-dimethoxyphenol.

Molecular Properties

Compound Name4-[(E)-3-hydroxyprop-1-enyl]-2,6-dimethoxyphenol
PubChem CID5280507
Molecular FormulaC11H14O4
Molecular Weight210.23 g/mol
Exact Mass210.09
IUPAC Name4-[(E)-3-hydroxyprop-1-enyl]-2,6-dimethoxyphenol
SMILESCOc1cc(/C=C/CO)cc(OC)c1O
InChIInChI=1S/C11H14O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-4,6-7,12-13H,5H2,1-2H3/b4-3+
InChIKeyLZFOPEXOUVTGJS-ONEGZZNKSA-N
XLogP1.41
TPSA58.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.23
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[(E)-3-hydroxyprop-1-enyl]-2,6-dimethoxyphenol?
The IUPAC name of 4-[(E)-3-hydroxyprop-1-enyl]-2,6-dimethoxyphenol (CID 5280507) is 4-[(E)-3-hydroxyprop-1-enyl]-2,6-dimethoxyphenol.
What is the SMILES notation for 4-[(E)-3-hydroxyprop-1-enyl]-2,6-dimethoxyphenol?
The canonical SMILES for 4-[(E)-3-hydroxyprop-1-enyl]-2,6-dimethoxyphenol is COc1cc(/C=C/CO)cc(OC)c1O.
What is the InChIKey of 4-[(E)-3-hydroxyprop-1-enyl]-2,6-dimethoxyphenol?
The InChIKey is LZFOPEXOUVTGJS-ONEGZZNKSA-N. The full InChI is InChI=1S/C11H14O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-4,6-7,12-13H,5H2,1-2H3/b4-3+.
What are the key properties of 4-[(E)-3-hydroxyprop-1-enyl]-2,6-dimethoxyphenol?
4-[(E)-3-hydroxyprop-1-enyl]-2,6-dimethoxyphenol has a molecular weight of 210.23 g/mol, XLogP of 1.41, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(E)-3-hydroxyprop-1-enyl]-2,6-dimethoxyphenol is sourced from PubChem (CID 5280507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).