2-[(E)-2-(2,4-dimethoxyphenyl)ethenyl]phenol

C16H16O3 — CID 56681826

IUPAC2-[(E)-2-(2,4-dimethoxyphenyl)ethenyl]phenol
SMILESCOc1ccc(/C=C/c2ccccc2O)c(OC)c1
InChIInChI=1S/C16H16O3/c1-18-14-10-9-13(16(11-14)19-2)8-7-12-5-3-4-6-15(12)17/h3-11,17H,1-2H3/b8-7+
InChIKeyLFWJEBVAKIRPFZ-BQYQJAHWSA-N
MW256.30 g/mol
LogP3.58
Rot. Bonds4

About 2-[(E)-2-(2,4-dimethoxyphenyl)ethenyl]phenol

2-[(E)-2-(2,4-dimethoxyphenyl)ethenyl]phenol (PubChem CID 56681826) has the molecular formula C16H16O3 and a molecular weight of 256.30 g/mol. Its IUPAC name is 2-[(E)-2-(2,4-dimethoxyphenyl)ethenyl]phenol.

Molecular Properties

Compound Name2-[(E)-2-(2,4-dimethoxyphenyl)ethenyl]phenol
PubChem CID56681826
Molecular FormulaC16H16O3
Molecular Weight256.30 g/mol
Exact Mass256.11
IUPAC Name2-[(E)-2-(2,4-dimethoxyphenyl)ethenyl]phenol
SMILESCOc1ccc(/C=C/c2ccccc2O)c(OC)c1
InChIInChI=1S/C16H16O3/c1-18-14-10-9-13(16(11-14)19-2)8-7-12-5-3-4-6-15(12)17/h3-11,17H,1-2H3/b8-7+
InChIKeyLFWJEBVAKIRPFZ-BQYQJAHWSA-N
XLogP3.58
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.30
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-[(Z)-2-[2-[(E)-2-(2,4-dimethoxyphenyl)ethenyl]phenyl]ethenyl]-2,4-dimethoxybenzene
CID 171376648
4-[(E)-2-(2,4-dimethoxyphenyl)ethenyl]-2,6-dimethoxyphenol
CID 72723773
1-[(E)-2-(2-bromo-3-methoxyphenyl)ethenyl]-2,4-dimethoxybenzene
CID 59502056
2,4-dimethoxy-1-[(E)-2-(3-methoxyphenyl)ethenyl]benzene
CID 90666858
1-[(Z)-2-(2,4-dimethoxyphenyl)ethenyl]-3,5-dimethoxybenzene
CID 6604874
4-[2-(2,4-dimethoxyphenyl)ethenoxy]phenol
CID 131632823
2,4-dimethoxy-1-[(1E,3E)-penta-1,3-dienyl]benzene
CID 90326933
3-[(E)-2-(2-hydroxyphenyl)ethenyl]-5-methoxyphenol
CID 102318988
(1E,6E)-1,7-bis(2,4-dimethoxyphenyl)hepta-1,6-diene-3,5-dione
CID 68552465
2-[(E)-2-(2,4-dimethoxyphenyl)ethenyl]-1,3-benzoxazole
CID 18083405
5-methoxy-2-[(E)-prop-1-enyl]phenol
CID 18539717
(E)-3-(2,4-dimethoxyphenyl)-1-(2-methylphenyl)prop-2-en-1-one
CID 9448321

Frequently Asked Questions

What is the IUPAC name of 2-[(E)-2-(2,4-dimethoxyphenyl)ethenyl]phenol?
The IUPAC name of 2-[(E)-2-(2,4-dimethoxyphenyl)ethenyl]phenol (CID 56681826) is 2-[(E)-2-(2,4-dimethoxyphenyl)ethenyl]phenol.
What is the SMILES notation for 2-[(E)-2-(2,4-dimethoxyphenyl)ethenyl]phenol?
The canonical SMILES for 2-[(E)-2-(2,4-dimethoxyphenyl)ethenyl]phenol is COc1ccc(/C=C/c2ccccc2O)c(OC)c1.
What is the InChIKey of 2-[(E)-2-(2,4-dimethoxyphenyl)ethenyl]phenol?
The InChIKey is LFWJEBVAKIRPFZ-BQYQJAHWSA-N. The full InChI is InChI=1S/C16H16O3/c1-18-14-10-9-13(16(11-14)19-2)8-7-12-5-3-4-6-15(12)17/h3-11,17H,1-2H3/b8-7+.
What are the key properties of 2-[(E)-2-(2,4-dimethoxyphenyl)ethenyl]phenol?
2-[(E)-2-(2,4-dimethoxyphenyl)ethenyl]phenol has a molecular weight of 256.30 g/mol, XLogP of 3.58, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-2-(2,4-dimethoxyphenyl)ethenyl]phenol is sourced from PubChem (CID 56681826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).