(2E,5Z)-5,6-diphenylhepta-2,5-dien-1-ol

C19H20O — CID 102291827

IUPAC(2E,5Z)-5,6-diphenylhepta-2,5-dien-1-ol
SMILESC/C(=C(\C/C=C/CO)c1ccccc1)c1ccccc1
InChIInChI=1S/C19H20O/c1-16(17-10-4-2-5-11-17)19(14-8-9-15-20)18-12-6-3-7-13-18/h2-13,20H,14-15H2,1H3/b9-8+,19-16-
InChIKeyRCNQWGCJKWHEAK-DFVMKROZSA-N
MW264.37 g/mol
LogP4.56
Rot. Bonds5

About (2E,5Z)-5,6-diphenylhepta-2,5-dien-1-ol

(2E,5Z)-5,6-diphenylhepta-2,5-dien-1-ol (PubChem CID 102291827) has the molecular formula C19H20O and a molecular weight of 264.37 g/mol. Its IUPAC name is (2E,5Z)-5,6-diphenylhepta-2,5-dien-1-ol.

Molecular Properties

Compound Name(2E,5Z)-5,6-diphenylhepta-2,5-dien-1-ol
PubChem CID102291827
Molecular FormulaC19H20O
Molecular Weight264.37 g/mol
Exact Mass264.15
IUPAC Name(2E,5Z)-5,6-diphenylhepta-2,5-dien-1-ol
SMILESC/C(=C(\C/C=C/CO)c1ccccc1)c1ccccc1
InChIInChI=1S/C19H20O/c1-16(17-10-4-2-5-11-17)19(14-8-9-15-20)18-12-6-3-7-13-18/h2-13,20H,14-15H2,1H3/b9-8+,19-16-
InChIKeyRCNQWGCJKWHEAK-DFVMKROZSA-N
XLogP4.56
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2E,5Z)-5,6-diphenylhepta-2,5-dien-1-ol?
The IUPAC name of (2E,5Z)-5,6-diphenylhepta-2,5-dien-1-ol (CID 102291827) is (2E,5Z)-5,6-diphenylhepta-2,5-dien-1-ol.
What is the SMILES notation for (2E,5Z)-5,6-diphenylhepta-2,5-dien-1-ol?
The canonical SMILES for (2E,5Z)-5,6-diphenylhepta-2,5-dien-1-ol is C/C(=C(\C/C=C/CO)c1ccccc1)c1ccccc1.
What is the InChIKey of (2E,5Z)-5,6-diphenylhepta-2,5-dien-1-ol?
The InChIKey is RCNQWGCJKWHEAK-DFVMKROZSA-N. The full InChI is InChI=1S/C19H20O/c1-16(17-10-4-2-5-11-17)19(14-8-9-15-20)18-12-6-3-7-13-18/h2-13,20H,14-15H2,1H3/b9-8+,19-16-.
What are the key properties of (2E,5Z)-5,6-diphenylhepta-2,5-dien-1-ol?
(2E,5Z)-5,6-diphenylhepta-2,5-dien-1-ol has a molecular weight of 264.37 g/mol, XLogP of 4.56, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,5Z)-5,6-diphenylhepta-2,5-dien-1-ol is sourced from PubChem (CID 102291827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).