4-[2-[ethoxy(fluoro)phosphoryl]ethenyl]-2-methoxyphenol

C11H14FO4P — CID 73023288

IUPAC4-[2-[ethoxy(fluoro)phosphoryl]ethenyl]-2-methoxyphenol
SMILESCCOP(=O)(F)C=Cc1ccc(O)c(OC)c1
InChIInChI=1S/C11H14FO4P/c1-3-16-17(12,14)7-6-9-4-5-10(13)11(8-9)15-2/h4-8,13H,3H2,1-2H3
InChIKeyOQRYVZWUEIPNDQ-UHFFFAOYSA-N
MW260.20 g/mol
LogP3.57
Rot. Bonds5

About 4-[2-[ethoxy(fluoro)phosphoryl]ethenyl]-2-methoxyphenol

4-[2-[ethoxy(fluoro)phosphoryl]ethenyl]-2-methoxyphenol (PubChem CID 73023288) has the molecular formula C11H14FO4P and a molecular weight of 260.20 g/mol. Its IUPAC name is 4-[2-[ethoxy(fluoro)phosphoryl]ethenyl]-2-methoxyphenol.

Molecular Properties

Compound Name4-[2-[ethoxy(fluoro)phosphoryl]ethenyl]-2-methoxyphenol
PubChem CID73023288
Molecular FormulaC11H14FO4P
Molecular Weight260.20 g/mol
Exact Mass260.06
IUPAC Name4-[2-[ethoxy(fluoro)phosphoryl]ethenyl]-2-methoxyphenol
SMILESCCOP(=O)(F)C=Cc1ccc(O)c(OC)c1
InChIInChI=1S/C11H14FO4P/c1-3-16-17(12,14)7-6-9-4-5-10(13)11(8-9)15-2/h4-8,13H,3H2,1-2H3
InChIKeyOQRYVZWUEIPNDQ-UHFFFAOYSA-N
XLogP3.57
TPSA55.76 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.20
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

4-[(E)-2-[ethoxy(fluoro)phosphoryl]ethenyl]-2-methoxyphenol
CID 11594103
1-(4-hydroxy-3-methoxyphenyl)hepta-1,4-dien-3-one
CID 175197578
(1E,6E)-1,7-bis(4-hydroxy-3-methoxyphenyl)hepta-1,6-diene-3,5-dione
CID 969516
[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl] (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-eneperoxoate
CID 155779332
1-(3-ethoxy-4-hydroxyphenyl)-7-(4-hydroxy-3-methoxyphenyl)hepta-1,6-diene-3,5-dione
CID 67010274
3-(4-hydroxy-3-methoxyphenyl)prop-2-enal;(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enal
CID 172694499
(1E,6E)-1,7-bis(4-hydroxy-3-methoxyphenyl)hepta-1,6-diene-3,5-dione;silver
CID 174575212
4-[(Z)-2-(4-hydroxyphenyl)ethenyl]-2-methoxyphenol
CID 10377070
4-[(E)-2-[3-[(E)-2-(4-hydroxy-3-methoxyphenyl)ethenyl]phenyl]ethenyl]-2-methoxyphenol
CID 11406193
ethane;(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enal
CID 145227199
benzene;(1E,6E)-1,7-bis(4-hydroxy-3-methoxyphenyl)hepta-1,6-diene-3,5-dione
CID 174945129
4-[(E)-2-[[(E)-2-(4-hydroxy-3-methoxyphenyl)ethenyl]sulfinylmethylsulfinyl]ethenyl]-2-methoxyphenol
CID 57480449

Frequently Asked Questions

What is the IUPAC name of 4-[2-[ethoxy(fluoro)phosphoryl]ethenyl]-2-methoxyphenol?
The IUPAC name of 4-[2-[ethoxy(fluoro)phosphoryl]ethenyl]-2-methoxyphenol (CID 73023288) is 4-[2-[ethoxy(fluoro)phosphoryl]ethenyl]-2-methoxyphenol.
What is the SMILES notation for 4-[2-[ethoxy(fluoro)phosphoryl]ethenyl]-2-methoxyphenol?
The canonical SMILES for 4-[2-[ethoxy(fluoro)phosphoryl]ethenyl]-2-methoxyphenol is CCOP(=O)(F)C=Cc1ccc(O)c(OC)c1.
What is the InChIKey of 4-[2-[ethoxy(fluoro)phosphoryl]ethenyl]-2-methoxyphenol?
The InChIKey is OQRYVZWUEIPNDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FO4P/c1-3-16-17(12,14)7-6-9-4-5-10(13)11(8-9)15-2/h4-8,13H,3H2,1-2H3.
What are the key properties of 4-[2-[ethoxy(fluoro)phosphoryl]ethenyl]-2-methoxyphenol?
4-[2-[ethoxy(fluoro)phosphoryl]ethenyl]-2-methoxyphenol has a molecular weight of 260.20 g/mol, XLogP of 3.57, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[ethoxy(fluoro)phosphoryl]ethenyl]-2-methoxyphenol is sourced from PubChem (CID 73023288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).