1,4-bis[(Z)-2-(4-methylphenyl)ethenyl]naphthalene

C28H24 — CID 147563124

IUPAC1,4-bis[(Z)-2-(4-methylphenyl)ethenyl]naphthalene
SMILESCc1ccc(/C=C\c2ccc(/C=C\c3ccc(C)cc3)c3ccccc23)cc1
InChIInChI=1S/C28H24/c1-21-7-11-23(12-8-21)15-17-25-19-20-26(28-6-4-3-5-27(25)28)18-16-24-13-9-22(2)10-14-24/h3-20H,1-2H3/b17-15-,18-16-
InChIKeyFTAKQGBXUQRQFK-IQRFGFHNSA-N
MW360.50 g/mol
LogP7.80
Rot. Bonds4

About 1,4-bis[(Z)-2-(4-methylphenyl)ethenyl]naphthalene

1,4-bis[(Z)-2-(4-methylphenyl)ethenyl]naphthalene (PubChem CID 147563124) has the molecular formula C28H24 and a molecular weight of 360.50 g/mol. Its IUPAC name is 1,4-bis[(Z)-2-(4-methylphenyl)ethenyl]naphthalene.

Molecular Properties

Compound Name1,4-bis[(Z)-2-(4-methylphenyl)ethenyl]naphthalene
PubChem CID147563124
Molecular FormulaC28H24
Molecular Weight360.50 g/mol
Exact Mass360.19
IUPAC Name1,4-bis[(Z)-2-(4-methylphenyl)ethenyl]naphthalene
SMILESCc1ccc(/C=C\c2ccc(/C=C\c3ccc(C)cc3)c3ccccc23)cc1
InChIInChI=1S/C28H24/c1-21-7-11-23(12-8-21)15-17-25-19-20-26(28-6-4-3-5-27(25)28)18-16-24-13-9-22(2)10-14-24/h3-20H,1-2H3/b17-15-,18-16-
InChIKeyFTAKQGBXUQRQFK-IQRFGFHNSA-N
XLogP7.80
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500360.50
LogP ≤ 57.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,4-bis[(Z)-2-(4-methylphenyl)ethenyl]naphthalene?
The IUPAC name of 1,4-bis[(Z)-2-(4-methylphenyl)ethenyl]naphthalene (CID 147563124) is 1,4-bis[(Z)-2-(4-methylphenyl)ethenyl]naphthalene.
What is the SMILES notation for 1,4-bis[(Z)-2-(4-methylphenyl)ethenyl]naphthalene?
The canonical SMILES for 1,4-bis[(Z)-2-(4-methylphenyl)ethenyl]naphthalene is Cc1ccc(/C=C\c2ccc(/C=C\c3ccc(C)cc3)c3ccccc23)cc1.
What is the InChIKey of 1,4-bis[(Z)-2-(4-methylphenyl)ethenyl]naphthalene?
The InChIKey is FTAKQGBXUQRQFK-IQRFGFHNSA-N. The full InChI is InChI=1S/C28H24/c1-21-7-11-23(12-8-21)15-17-25-19-20-26(28-6-4-3-5-27(25)28)18-16-24-13-9-22(2)10-14-24/h3-20H,1-2H3/b17-15-,18-16-.
What are the key properties of 1,4-bis[(Z)-2-(4-methylphenyl)ethenyl]naphthalene?
1,4-bis[(Z)-2-(4-methylphenyl)ethenyl]naphthalene has a molecular weight of 360.50 g/mol, XLogP of 7.80, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-bis[(Z)-2-(4-methylphenyl)ethenyl]naphthalene is sourced from PubChem (CID 147563124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).