2-[(Z)-2-phenylbut-1-enyl]phenol

C16H16O — CID 11031503

IUPAC2-[(Z)-2-phenylbut-1-enyl]phenol
SMILESCC/C(=C/c1ccccc1O)c1ccccc1
InChIInChI=1S/C16H16O/c1-2-13(14-8-4-3-5-9-14)12-15-10-6-7-11-16(15)17/h3-12,17H,2H2,1H3/b13-12-
InChIKeyXKAKLMIFZGISKZ-SEYXRHQNSA-N
MW224.30 g/mol
LogP4.34
Rot. Bonds3

About 2-[(Z)-2-phenylbut-1-enyl]phenol

2-[(Z)-2-phenylbut-1-enyl]phenol (PubChem CID 11031503) has the molecular formula C16H16O and a molecular weight of 224.30 g/mol. Its IUPAC name is 2-[(Z)-2-phenylbut-1-enyl]phenol.

Molecular Properties

Compound Name2-[(Z)-2-phenylbut-1-enyl]phenol
PubChem CID11031503
Molecular FormulaC16H16O
Molecular Weight224.30 g/mol
Exact Mass224.12
IUPAC Name2-[(Z)-2-phenylbut-1-enyl]phenol
SMILESCC/C(=C/c1ccccc1O)c1ccccc1
InChIInChI=1S/C16H16O/c1-2-13(14-8-4-3-5-9-14)12-15-10-6-7-11-16(15)17/h3-12,17H,2H2,1H3/b13-12-
InChIKeyXKAKLMIFZGISKZ-SEYXRHQNSA-N
XLogP4.34
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[(Z)-2-phenylbut-1-enyl]phenol?
The IUPAC name of 2-[(Z)-2-phenylbut-1-enyl]phenol (CID 11031503) is 2-[(Z)-2-phenylbut-1-enyl]phenol.
What is the SMILES notation for 2-[(Z)-2-phenylbut-1-enyl]phenol?
The canonical SMILES for 2-[(Z)-2-phenylbut-1-enyl]phenol is CC/C(=C/c1ccccc1O)c1ccccc1.
What is the InChIKey of 2-[(Z)-2-phenylbut-1-enyl]phenol?
The InChIKey is XKAKLMIFZGISKZ-SEYXRHQNSA-N. The full InChI is InChI=1S/C16H16O/c1-2-13(14-8-4-3-5-9-14)12-15-10-6-7-11-16(15)17/h3-12,17H,2H2,1H3/b13-12-.
What are the key properties of 2-[(Z)-2-phenylbut-1-enyl]phenol?
2-[(Z)-2-phenylbut-1-enyl]phenol has a molecular weight of 224.30 g/mol, XLogP of 4.34, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(Z)-2-phenylbut-1-enyl]phenol is sourced from PubChem (CID 11031503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).