(1E,7E)-5-hydroxy-1,8-diphenylocta-1,7-dien-4-one

C20H20O2 — CID 101237032

IUPAC(1E,7E)-5-hydroxy-1,8-diphenylocta-1,7-dien-4-one
SMILESO=C(C/C=C/c1ccccc1)C(O)C/C=C/c1ccccc1
InChIInChI=1S/C20H20O2/c21-19(15-7-13-17-9-3-1-4-10-17)20(22)16-8-14-18-11-5-2-6-12-18/h1-14,19,21H,15-16H2/b13-7+,14-8+
InChIKeyUBBFOYRKCNCCGZ-FNCQTZNRSA-N
MW292.38 g/mol
LogP4.12
Rot. Bonds7

About (1E,7E)-5-hydroxy-1,8-diphenylocta-1,7-dien-4-one

(1E,7E)-5-hydroxy-1,8-diphenylocta-1,7-dien-4-one (PubChem CID 101237032) has the molecular formula C20H20O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is (1E,7E)-5-hydroxy-1,8-diphenylocta-1,7-dien-4-one.

Molecular Properties

Compound Name(1E,7E)-5-hydroxy-1,8-diphenylocta-1,7-dien-4-one
PubChem CID101237032
Molecular FormulaC20H20O2
Molecular Weight292.38 g/mol
Exact Mass292.15
IUPAC Name(1E,7E)-5-hydroxy-1,8-diphenylocta-1,7-dien-4-one
SMILESO=C(C/C=C/c1ccccc1)C(O)C/C=C/c1ccccc1
InChIInChI=1S/C20H20O2/c21-19(15-7-13-17-9-3-1-4-10-17)20(22)16-8-14-18-11-5-2-6-12-18/h1-14,19,21H,15-16H2/b13-7+,14-8+
InChIKeyUBBFOYRKCNCCGZ-FNCQTZNRSA-N
XLogP4.12
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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(1E,5E)-1-phenylhepta-1,5-dien-4-ol
CID 100975516
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Frequently Asked Questions

What is the IUPAC name of (1E,7E)-5-hydroxy-1,8-diphenylocta-1,7-dien-4-one?
The IUPAC name of (1E,7E)-5-hydroxy-1,8-diphenylocta-1,7-dien-4-one (CID 101237032) is (1E,7E)-5-hydroxy-1,8-diphenylocta-1,7-dien-4-one.
What is the SMILES notation for (1E,7E)-5-hydroxy-1,8-diphenylocta-1,7-dien-4-one?
The canonical SMILES for (1E,7E)-5-hydroxy-1,8-diphenylocta-1,7-dien-4-one is O=C(C/C=C/c1ccccc1)C(O)C/C=C/c1ccccc1.
What is the InChIKey of (1E,7E)-5-hydroxy-1,8-diphenylocta-1,7-dien-4-one?
The InChIKey is UBBFOYRKCNCCGZ-FNCQTZNRSA-N. The full InChI is InChI=1S/C20H20O2/c21-19(15-7-13-17-9-3-1-4-10-17)20(22)16-8-14-18-11-5-2-6-12-18/h1-14,19,21H,15-16H2/b13-7+,14-8+.
What are the key properties of (1E,7E)-5-hydroxy-1,8-diphenylocta-1,7-dien-4-one?
(1E,7E)-5-hydroxy-1,8-diphenylocta-1,7-dien-4-one has a molecular weight of 292.38 g/mol, XLogP of 4.12, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1E,7E)-5-hydroxy-1,8-diphenylocta-1,7-dien-4-one is sourced from PubChem (CID 101237032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).