1-[(E)-2-(4-ethylcyclohexa-1,3-dien-1-yl)ethenyl]-4-[(E)-2-phenylethenyl]benzene

C24H24 — CID 164529280

IUPAC1-[(E)-2-(4-ethylcyclohexa-1,3-dien-1-yl)ethenyl]-4-[(E)-2-phenylethenyl]benzene
SMILESCCC1=CC=C(/C=C/c2ccc(/C=C/c3ccccc3)cc2)CC1
InChIInChI=1S/C24H24/c1-2-20-8-10-22(11-9-20)14-15-24-18-16-23(17-19-24)13-12-21-6-4-3-5-7-21/h3-8,10,12-19H,2,9,11H2,1H3/b13-12+,15-14+
InChIKeyVRURFFDXGBYPMT-SQIWNDBBSA-N
MW312.46 g/mol
LogP6.93
Rot. Bonds5

About 1-[(E)-2-(4-ethylcyclohexa-1,3-dien-1-yl)ethenyl]-4-[(E)-2-phenylethenyl]benzene

1-[(E)-2-(4-ethylcyclohexa-1,3-dien-1-yl)ethenyl]-4-[(E)-2-phenylethenyl]benzene (PubChem CID 164529280) has the molecular formula C24H24 and a molecular weight of 312.46 g/mol. Its IUPAC name is 1-[(E)-2-(4-ethylcyclohexa-1,3-dien-1-yl)ethenyl]-4-[(E)-2-phenylethenyl]benzene.

Molecular Properties

Compound Name1-[(E)-2-(4-ethylcyclohexa-1,3-dien-1-yl)ethenyl]-4-[(E)-2-phenylethenyl]benzene
PubChem CID164529280
Molecular FormulaC24H24
Molecular Weight312.46 g/mol
Exact Mass312.19
IUPAC Name1-[(E)-2-(4-ethylcyclohexa-1,3-dien-1-yl)ethenyl]-4-[(E)-2-phenylethenyl]benzene
SMILESCCC1=CC=C(/C=C/c2ccc(/C=C/c3ccccc3)cc2)CC1
InChIInChI=1S/C24H24/c1-2-20-8-10-22(11-9-20)14-15-24-18-16-23(17-19-24)13-12-21-6-4-3-5-7-21/h3-8,10,12-19H,2,9,11H2,1H3/b13-12+,15-14+
InChIKeyVRURFFDXGBYPMT-SQIWNDBBSA-N
XLogP6.93
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500312.46
LogP ≤ 56.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1-bromo-4-[2-(4-bromocyclohexa-1,3-dien-1-yl)ethenyl]benzene
CID 130391856
CID 70567885
CID 70567885
CID 70569152
CID 70569152
N-[4-[2-[4-(dinaphthalen-2-ylamino)phenyl]ethenyl]cyclohexa-1,3-dien-1-yl]-N-naphthalen-2-ylnaphthalen-2-amine
CID 89331361
2-methyl-5-[(E)-2-phenylethenyl]pyridine
CID 11095539
ethyl-dihydroxy-[(E)-2-phenylethenyl]silane
CID 10559740
1-ethyl-2-[(Z)-2-phenylethenyl]benzene
CID 142017215
carbanide;ethane;methane;1-(2-phenylethenyl)-4-[4-(2-phenylethenyl)phenyl]benzene;propane;yttrium
CID 159447885
1-ethoxy-4-(2-phenylethenyl)benzene
CID 54277622
bis[4-[2-(4-ethylphenyl)ethenyl]phenyl]-dimethylsilane
CID 72543241
N,N-dimethylmethanamine;stilbene
CID 174368184
benzene;5-(2-phenylethenyl)cyclohexa-2,4-diene-1,1-diamine
CID 174421123

Frequently Asked Questions

What is the IUPAC name of 1-[(E)-2-(4-ethylcyclohexa-1,3-dien-1-yl)ethenyl]-4-[(E)-2-phenylethenyl]benzene?
The IUPAC name of 1-[(E)-2-(4-ethylcyclohexa-1,3-dien-1-yl)ethenyl]-4-[(E)-2-phenylethenyl]benzene (CID 164529280) is 1-[(E)-2-(4-ethylcyclohexa-1,3-dien-1-yl)ethenyl]-4-[(E)-2-phenylethenyl]benzene.
What is the SMILES notation for 1-[(E)-2-(4-ethylcyclohexa-1,3-dien-1-yl)ethenyl]-4-[(E)-2-phenylethenyl]benzene?
The canonical SMILES for 1-[(E)-2-(4-ethylcyclohexa-1,3-dien-1-yl)ethenyl]-4-[(E)-2-phenylethenyl]benzene is CCC1=CC=C(/C=C/c2ccc(/C=C/c3ccccc3)cc2)CC1.
What is the InChIKey of 1-[(E)-2-(4-ethylcyclohexa-1,3-dien-1-yl)ethenyl]-4-[(E)-2-phenylethenyl]benzene?
The InChIKey is VRURFFDXGBYPMT-SQIWNDBBSA-N. The full InChI is InChI=1S/C24H24/c1-2-20-8-10-22(11-9-20)14-15-24-18-16-23(17-19-24)13-12-21-6-4-3-5-7-21/h3-8,10,12-19H,2,9,11H2,1H3/b13-12+,15-14+.
What are the key properties of 1-[(E)-2-(4-ethylcyclohexa-1,3-dien-1-yl)ethenyl]-4-[(E)-2-phenylethenyl]benzene?
1-[(E)-2-(4-ethylcyclohexa-1,3-dien-1-yl)ethenyl]-4-[(E)-2-phenylethenyl]benzene has a molecular weight of 312.46 g/mol, XLogP of 6.93, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(E)-2-(4-ethylcyclohexa-1,3-dien-1-yl)ethenyl]-4-[(E)-2-phenylethenyl]benzene is sourced from PubChem (CID 164529280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).