(E)-1,2,3-triphenylprop-2-en-1-ol

C21H18O — CID 6534349

IUPAC(E)-1,2,3-triphenylprop-2-en-1-ol
SMILESOC(/C(=C/c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C21H18O/c22-21(19-14-8-3-9-15-19)20(18-12-6-2-7-13-18)16-17-10-4-1-5-11-17/h1-16,21-22H/b20-16+
InChIKeyQMCPCLHQCXJHSB-CAPFRKAQSA-N
MW286.37 g/mol
LogP4.96
Rot. Bonds4

About (E)-1,2,3-triphenylprop-2-en-1-ol

(E)-1,2,3-triphenylprop-2-en-1-ol (PubChem CID 6534349) has the molecular formula C21H18O and a molecular weight of 286.37 g/mol. Its IUPAC name is (E)-1,2,3-triphenylprop-2-en-1-ol.

Molecular Properties

Compound Name(E)-1,2,3-triphenylprop-2-en-1-ol
PubChem CID6534349
Molecular FormulaC21H18O
Molecular Weight286.37 g/mol
Exact Mass286.14
IUPAC Name(E)-1,2,3-triphenylprop-2-en-1-ol
SMILESOC(/C(=C/c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C21H18O/c22-21(19-14-8-3-9-15-19)20(18-12-6-2-7-13-18)16-17-10-4-1-5-11-17/h1-16,21-22H/b20-16+
InChIKeyQMCPCLHQCXJHSB-CAPFRKAQSA-N
XLogP4.96
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.37
LogP ≤ 54.96
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 (E)-1,2,3-triphenylprop-2-en-1-ol?
The IUPAC name of (E)-1,2,3-triphenylprop-2-en-1-ol (CID 6534349) is (E)-1,2,3-triphenylprop-2-en-1-ol.
What is the SMILES notation for (E)-1,2,3-triphenylprop-2-en-1-ol?
The canonical SMILES for (E)-1,2,3-triphenylprop-2-en-1-ol is OC(/C(=C/c1ccccc1)c1ccccc1)c1ccccc1.
What is the InChIKey of (E)-1,2,3-triphenylprop-2-en-1-ol?
The InChIKey is QMCPCLHQCXJHSB-CAPFRKAQSA-N. The full InChI is InChI=1S/C21H18O/c22-21(19-14-8-3-9-15-19)20(18-12-6-2-7-13-18)16-17-10-4-1-5-11-17/h1-16,21-22H/b20-16+.
What are the key properties of (E)-1,2,3-triphenylprop-2-en-1-ol?
(E)-1,2,3-triphenylprop-2-en-1-ol has a molecular weight of 286.37 g/mol, XLogP of 4.96, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1,2,3-triphenylprop-2-en-1-ol is sourced from PubChem (CID 6534349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).