1,2-dimethyl-4-[(E)-2-naphthalen-1-ylethenyl]naphthalene

C24H20 — CID 6253992

IUPAC1,2-dimethyl-4-[(E)-2-naphthalen-1-ylethenyl]naphthalene
SMILESCc1cc(/C=C/c2cccc3ccccc23)c2ccccc2c1C
InChIInChI=1S/C24H20/c1-17-16-21(24-13-6-5-11-22(24)18(17)2)15-14-20-10-7-9-19-8-3-4-12-23(19)20/h3-16H,1-2H3/b15-14+
InChIKeyFXIAWZUVYQFFOG-CCEZHUSRSA-N
MW308.42 g/mol
LogP6.78
Rot. Bonds2

About 1,2-dimethyl-4-[(E)-2-naphthalen-1-ylethenyl]naphthalene

1,2-dimethyl-4-[(E)-2-naphthalen-1-ylethenyl]naphthalene (PubChem CID 6253992) has the molecular formula C24H20 and a molecular weight of 308.42 g/mol. Its IUPAC name is 1,2-dimethyl-4-[(E)-2-naphthalen-1-ylethenyl]naphthalene.

Molecular Properties

Compound Name1,2-dimethyl-4-[(E)-2-naphthalen-1-ylethenyl]naphthalene
PubChem CID6253992
Molecular FormulaC24H20
Molecular Weight308.42 g/mol
Exact Mass308.16
IUPAC Name1,2-dimethyl-4-[(E)-2-naphthalen-1-ylethenyl]naphthalene
SMILESCc1cc(/C=C/c2cccc3ccccc23)c2ccccc2c1C
InChIInChI=1S/C24H20/c1-17-16-21(24-13-6-5-11-22(24)18(17)2)15-14-20-10-7-9-19-8-3-4-12-23(19)20/h3-16H,1-2H3/b15-14+
InChIKeyFXIAWZUVYQFFOG-CCEZHUSRSA-N
XLogP6.78
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500308.42
LogP ≤ 56.78
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 1,2-dimethyl-4-[(E)-2-naphthalen-1-ylethenyl]naphthalene?
The IUPAC name of 1,2-dimethyl-4-[(E)-2-naphthalen-1-ylethenyl]naphthalene (CID 6253992) is 1,2-dimethyl-4-[(E)-2-naphthalen-1-ylethenyl]naphthalene.
What is the SMILES notation for 1,2-dimethyl-4-[(E)-2-naphthalen-1-ylethenyl]naphthalene?
The canonical SMILES for 1,2-dimethyl-4-[(E)-2-naphthalen-1-ylethenyl]naphthalene is Cc1cc(/C=C/c2cccc3ccccc23)c2ccccc2c1C.
What is the InChIKey of 1,2-dimethyl-4-[(E)-2-naphthalen-1-ylethenyl]naphthalene?
The InChIKey is FXIAWZUVYQFFOG-CCEZHUSRSA-N. The full InChI is InChI=1S/C24H20/c1-17-16-21(24-13-6-5-11-22(24)18(17)2)15-14-20-10-7-9-19-8-3-4-12-23(19)20/h3-16H,1-2H3/b15-14+.
What are the key properties of 1,2-dimethyl-4-[(E)-2-naphthalen-1-ylethenyl]naphthalene?
1,2-dimethyl-4-[(E)-2-naphthalen-1-ylethenyl]naphthalene has a molecular weight of 308.42 g/mol, XLogP of 6.78, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethyl-4-[(E)-2-naphthalen-1-ylethenyl]naphthalene is sourced from PubChem (CID 6253992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).