4-[(Z)-1-(4-ethoxyphenyl)-1-(4-hydroxyphenyl)but-1-en-2-yl]phenol

C24H24O3 — CID 46205471

IUPAC4-[(Z)-1-(4-ethoxyphenyl)-1-(4-hydroxyphenyl)but-1-en-2-yl]phenol
SMILESCCOc1ccc(/C(=C(/CC)c2ccc(O)cc2)c2ccc(O)cc2)cc1
InChIInChI=1S/C24H24O3/c1-3-23(17-5-11-20(25)12-6-17)24(18-7-13-21(26)14-8-18)19-9-15-22(16-10-19)27-4-2/h5-16,25-26H,3-4H2,1-2H3/b24-23-
InChIKeyARCUKWDDBMOVTN-VHXPQNKSSA-N
MW360.45 g/mol
LogP5.87
Rot. Bonds6

About 4-[(Z)-1-(4-ethoxyphenyl)-1-(4-hydroxyphenyl)but-1-en-2-yl]phenol

4-[(Z)-1-(4-ethoxyphenyl)-1-(4-hydroxyphenyl)but-1-en-2-yl]phenol (PubChem CID 46205471) has the molecular formula C24H24O3 and a molecular weight of 360.45 g/mol. Its IUPAC name is 4-[(Z)-1-(4-ethoxyphenyl)-1-(4-hydroxyphenyl)but-1-en-2-yl]phenol.

Molecular Properties

Compound Name4-[(Z)-1-(4-ethoxyphenyl)-1-(4-hydroxyphenyl)but-1-en-2-yl]phenol
PubChem CID46205471
Molecular FormulaC24H24O3
Molecular Weight360.45 g/mol
Exact Mass360.17
IUPAC Name4-[(Z)-1-(4-ethoxyphenyl)-1-(4-hydroxyphenyl)but-1-en-2-yl]phenol
SMILESCCOc1ccc(/C(=C(/CC)c2ccc(O)cc2)c2ccc(O)cc2)cc1
InChIInChI=1S/C24H24O3/c1-3-23(17-5-11-20(25)12-6-17)24(18-7-13-21(26)14-8-18)19-9-15-22(16-10-19)27-4-2/h5-16,25-26H,3-4H2,1-2H3/b24-23-
InChIKeyARCUKWDDBMOVTN-VHXPQNKSSA-N
XLogP5.87
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500360.45
LogP ≤ 55.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-[(Z)-1-(4-ethoxyphenyl)-1-(4-hydroxyphenyl)but-1-en-2-yl]phenol?
The IUPAC name of 4-[(Z)-1-(4-ethoxyphenyl)-1-(4-hydroxyphenyl)but-1-en-2-yl]phenol (CID 46205471) is 4-[(Z)-1-(4-ethoxyphenyl)-1-(4-hydroxyphenyl)but-1-en-2-yl]phenol.
What is the SMILES notation for 4-[(Z)-1-(4-ethoxyphenyl)-1-(4-hydroxyphenyl)but-1-en-2-yl]phenol?
The canonical SMILES for 4-[(Z)-1-(4-ethoxyphenyl)-1-(4-hydroxyphenyl)but-1-en-2-yl]phenol is CCOc1ccc(/C(=C(/CC)c2ccc(O)cc2)c2ccc(O)cc2)cc1.
What is the InChIKey of 4-[(Z)-1-(4-ethoxyphenyl)-1-(4-hydroxyphenyl)but-1-en-2-yl]phenol?
The InChIKey is ARCUKWDDBMOVTN-VHXPQNKSSA-N. The full InChI is InChI=1S/C24H24O3/c1-3-23(17-5-11-20(25)12-6-17)24(18-7-13-21(26)14-8-18)19-9-15-22(16-10-19)27-4-2/h5-16,25-26H,3-4H2,1-2H3/b24-23-.
What are the key properties of 4-[(Z)-1-(4-ethoxyphenyl)-1-(4-hydroxyphenyl)but-1-en-2-yl]phenol?
4-[(Z)-1-(4-ethoxyphenyl)-1-(4-hydroxyphenyl)but-1-en-2-yl]phenol has a molecular weight of 360.45 g/mol, XLogP of 5.87, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(Z)-1-(4-ethoxyphenyl)-1-(4-hydroxyphenyl)but-1-en-2-yl]phenol is sourced from PubChem (CID 46205471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).