2-[(E)-2-[4-[(E)-2-naphthalen-2-ylethenyl]phenyl]ethenyl]naphthalene

C30H22 — CID 20801533

IUPAC2-[(E)-2-[4-[(E)-2-naphthalen-2-ylethenyl]phenyl]ethenyl]naphthalene
SMILESC(=C/c1ccc2ccccc2c1)\c1ccc(/C=C/c2ccc3ccccc3c2)cc1
InChIInChI=1S/C30H22/c1-3-7-29-21-25(17-19-27(29)5-1)15-13-23-9-11-24(12-10-23)14-16-26-18-20-28-6-2-4-8-30(28)22-26/h1-22H/b15-13+,16-14+
InChIKeyFYGRKBKOHBYWNB-WXUKJITCSA-N
MW382.51 g/mol
LogP8.33
Rot. Bonds4

About 2-[(E)-2-[4-[(E)-2-naphthalen-2-ylethenyl]phenyl]ethenyl]naphthalene

2-[(E)-2-[4-[(E)-2-naphthalen-2-ylethenyl]phenyl]ethenyl]naphthalene (PubChem CID 20801533) has the molecular formula C30H22 and a molecular weight of 382.51 g/mol. Its IUPAC name is 2-[(E)-2-[4-[(E)-2-naphthalen-2-ylethenyl]phenyl]ethenyl]naphthalene.

Molecular Properties

Compound Name2-[(E)-2-[4-[(E)-2-naphthalen-2-ylethenyl]phenyl]ethenyl]naphthalene
PubChem CID20801533
Molecular FormulaC30H22
Molecular Weight382.51 g/mol
Exact Mass382.17
IUPAC Name2-[(E)-2-[4-[(E)-2-naphthalen-2-ylethenyl]phenyl]ethenyl]naphthalene
SMILESC(=C/c1ccc2ccccc2c1)\c1ccc(/C=C/c2ccc3ccccc3c2)cc1
InChIInChI=1S/C30H22/c1-3-7-29-21-25(17-19-27(29)5-1)15-13-23-9-11-24(12-10-23)14-16-26-18-20-28-6-2-4-8-30(28)22-26/h1-22H/b15-13+,16-14+
InChIKeyFYGRKBKOHBYWNB-WXUKJITCSA-N
XLogP8.33
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500382.51
LogP ≤ 58.33
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 2-[(E)-2-[4-[(E)-2-naphthalen-2-ylethenyl]phenyl]ethenyl]naphthalene?
The IUPAC name of 2-[(E)-2-[4-[(E)-2-naphthalen-2-ylethenyl]phenyl]ethenyl]naphthalene (CID 20801533) is 2-[(E)-2-[4-[(E)-2-naphthalen-2-ylethenyl]phenyl]ethenyl]naphthalene.
What is the SMILES notation for 2-[(E)-2-[4-[(E)-2-naphthalen-2-ylethenyl]phenyl]ethenyl]naphthalene?
The canonical SMILES for 2-[(E)-2-[4-[(E)-2-naphthalen-2-ylethenyl]phenyl]ethenyl]naphthalene is C(=C/c1ccc2ccccc2c1)\c1ccc(/C=C/c2ccc3ccccc3c2)cc1.
What is the InChIKey of 2-[(E)-2-[4-[(E)-2-naphthalen-2-ylethenyl]phenyl]ethenyl]naphthalene?
The InChIKey is FYGRKBKOHBYWNB-WXUKJITCSA-N. The full InChI is InChI=1S/C30H22/c1-3-7-29-21-25(17-19-27(29)5-1)15-13-23-9-11-24(12-10-23)14-16-26-18-20-28-6-2-4-8-30(28)22-26/h1-22H/b15-13+,16-14+.
What are the key properties of 2-[(E)-2-[4-[(E)-2-naphthalen-2-ylethenyl]phenyl]ethenyl]naphthalene?
2-[(E)-2-[4-[(E)-2-naphthalen-2-ylethenyl]phenyl]ethenyl]naphthalene has a molecular weight of 382.51 g/mol, XLogP of 8.33, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-2-[4-[(E)-2-naphthalen-2-ylethenyl]phenyl]ethenyl]naphthalene is sourced from PubChem (CID 20801533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).