4-(2-phenylethenyl)phenol

C28H24O2 — CID 157400568

IUPAC4-(2-phenylethenyl)phenol
SMILESOc1ccc(C=Cc2ccccc2)cc1.Oc1ccc(C=Cc2ccccc2)cc1
InChIInChI=1S/2C14H12O/c2*15-14-10-8-13(9-11-14)7-6-12-4-2-1-3-5-12/h2*1-11,15H
InChIKeyBNCKIABJXBODBF-UHFFFAOYSA-N
MW392.50 g/mol
LogP7.13
Rot. Bonds4

About 4-(2-phenylethenyl)phenol

4-(2-phenylethenyl)phenol (PubChem CID 157400568) has the molecular formula C28H24O2 and a molecular weight of 392.50 g/mol. Its IUPAC name is 4-(2-phenylethenyl)phenol.

Molecular Properties

Compound Name4-(2-phenylethenyl)phenol
PubChem CID157400568
Molecular FormulaC28H24O2
Molecular Weight392.50 g/mol
Exact Mass392.18
IUPAC Name4-(2-phenylethenyl)phenol
SMILESOc1ccc(C=Cc2ccccc2)cc1.Oc1ccc(C=Cc2ccccc2)cc1
InChIInChI=1S/2C14H12O/c2*15-14-10-8-13(9-11-14)7-6-12-4-2-1-3-5-12/h2*1-11,15H
InChIKeyBNCKIABJXBODBF-UHFFFAOYSA-N
XLogP7.13
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500392.50
LogP ≤ 57.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-[(E)-2-[4-[(E)-2-phenylethenyl]phenyl]ethenyl]phenol
CID 52942315
4-[2-(4-phenylphenyl)ethenyl]phenol
CID 73178657
4-[(E)-2-(3-phenoxyphenyl)ethenyl]phenol
CID 11587340
4-[N-(4-hydroxyphenyl)-4-[(1E,3E)-4-phenylbuta-1,3-dienyl]anilino]phenol
CID 59460181
CID 70567885
CID 70567885
CID 70569152
CID 70569152
4-[(E)-2-[4-[(E)-2-(4-hydroxyphenyl)ethenyl]phenyl]ethenyl]phenol;triiodovanadium
CID 157160802
4-[(E)-2-(4-chlorophenyl)ethenyl]phenol
CID 5376643
4-[(Z)-2-(4-aminophenyl)ethenyl]phenol
CID 25021233
hydride;rubidium(1+);stilbene
CID 173437843
disodium;hydride;(E)-stilbene
CID 173089328
4-[2-(3-bromophenyl)ethenyl]phenol
CID 68626612

Frequently Asked Questions

What is the IUPAC name of 4-(2-phenylethenyl)phenol?
The IUPAC name of 4-(2-phenylethenyl)phenol (CID 157400568) is 4-(2-phenylethenyl)phenol.
What is the SMILES notation for 4-(2-phenylethenyl)phenol?
The canonical SMILES for 4-(2-phenylethenyl)phenol is Oc1ccc(C=Cc2ccccc2)cc1.Oc1ccc(C=Cc2ccccc2)cc1.
What is the InChIKey of 4-(2-phenylethenyl)phenol?
The InChIKey is BNCKIABJXBODBF-UHFFFAOYSA-N. The full InChI is InChI=1S/2C14H12O/c2*15-14-10-8-13(9-11-14)7-6-12-4-2-1-3-5-12/h2*1-11,15H.
What are the key properties of 4-(2-phenylethenyl)phenol?
4-(2-phenylethenyl)phenol has a molecular weight of 392.50 g/mol, XLogP of 7.13, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-phenylethenyl)phenol is sourced from PubChem (CID 157400568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).