1-methoxy-4-[2-[4-[2-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]ethenyl]phenyl]ethenyl]benzene

C32H28O2 — CID 76573307

IUPAC1-methoxy-4-[2-[4-[2-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]ethenyl]phenyl]ethenyl]benzene
SMILESCOc1ccc(C=Cc2ccc(C=Cc3ccc(C=Cc4ccc(OC)cc4)cc3)cc2)cc1
InChIInChI=1S/C32H28O2/c1-33-31-21-17-29(18-22-31)15-13-27-9-5-25(6-10-27)3-4-26-7-11-28(12-8-26)14-16-30-19-23-32(34-2)24-20-30/h3-24H,1-2H3
InChIKeySJUOTZWGRQAJHJ-UHFFFAOYSA-N
MW444.57 g/mol
LogP8.22
Rot. Bonds8

About 1-methoxy-4-[2-[4-[2-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]ethenyl]phenyl]ethenyl]benzene

1-methoxy-4-[2-[4-[2-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]ethenyl]phenyl]ethenyl]benzene (PubChem CID 76573307) has the molecular formula C32H28O2 and a molecular weight of 444.57 g/mol. Its IUPAC name is 1-methoxy-4-[2-[4-[2-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]ethenyl]phenyl]ethenyl]benzene.

Molecular Properties

Compound Name1-methoxy-4-[2-[4-[2-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]ethenyl]phenyl]ethenyl]benzene
PubChem CID76573307
Molecular FormulaC32H28O2
Molecular Weight444.57 g/mol
Exact Mass444.21
IUPAC Name1-methoxy-4-[2-[4-[2-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]ethenyl]phenyl]ethenyl]benzene
SMILESCOc1ccc(C=Cc2ccc(C=Cc3ccc(C=Cc4ccc(OC)cc4)cc3)cc2)cc1
InChIInChI=1S/C32H28O2/c1-33-31-21-17-29(18-22-31)15-13-27-9-5-25(6-10-27)3-4-26-7-11-28(12-8-26)14-16-30-19-23-32(34-2)24-20-30/h3-24H,1-2H3
InChIKeySJUOTZWGRQAJHJ-UHFFFAOYSA-N
XLogP8.22
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500444.57
LogP ≤ 58.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-methoxy-4-[2-[4-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]phenyl]ethenyl]benzene
CID 54482883
1,3-dimethoxy-5-[2-(4-methoxy(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-trien-1-yl)ethenyl]benzene
CID 57369399
1-methoxy-4-prop-1-enylbenzene
CID 67322568
1-[(Z)-2-bromoethenyl]-4-methoxybenzene
CID 6166616
CID 135078844
CID 135078844
1-ethyl-4-[(E)-2-(4-methoxyphenyl)ethenyl]benzene
CID 21449166
4-[(Z)-2-(4-methoxyphenyl)ethenyl]-1,2-dimethylbenzene
CID 10999067
4-[(E)-2-(4-methoxyphenyl)ethenyl]-2,6-dimethylpyridine
CID 102336030
4-[(E)-2-[3-[(E)-2-[3,5-bis[(E)-2-[3,5-bis[(E)-2-(4-methoxyphenyl)ethenyl]phenyl]ethenyl]phenyl]ethenyl]-5-[(E)-2-(4-formylphenyl)ethenyl]phenyl]ethenyl]benzaldehyde
CID 102018921
4-[2-(4-methoxyphenyl)ethenyl]-1-methylpyridin-1-ium;hydroiodide
CID 126960038
2-[(Z)-2-(4-methoxyphenyl)ethenyl]-6-[(E)-2-(4-methoxyphenyl)ethenyl]pyridine
CID 92532273
1-methoxy-4-(4-phenylbuta-1,3-dienyl)benzene
CID 4560156

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-4-[2-[4-[2-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]ethenyl]phenyl]ethenyl]benzene?
The IUPAC name of 1-methoxy-4-[2-[4-[2-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]ethenyl]phenyl]ethenyl]benzene (CID 76573307) is 1-methoxy-4-[2-[4-[2-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]ethenyl]phenyl]ethenyl]benzene.
What is the SMILES notation for 1-methoxy-4-[2-[4-[2-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]ethenyl]phenyl]ethenyl]benzene?
The canonical SMILES for 1-methoxy-4-[2-[4-[2-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]ethenyl]phenyl]ethenyl]benzene is COc1ccc(C=Cc2ccc(C=Cc3ccc(C=Cc4ccc(OC)cc4)cc3)cc2)cc1.
What is the InChIKey of 1-methoxy-4-[2-[4-[2-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]ethenyl]phenyl]ethenyl]benzene?
The InChIKey is SJUOTZWGRQAJHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H28O2/c1-33-31-21-17-29(18-22-31)15-13-27-9-5-25(6-10-27)3-4-26-7-11-28(12-8-26)14-16-30-19-23-32(34-2)24-20-30/h3-24H,1-2H3.
What are the key properties of 1-methoxy-4-[2-[4-[2-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]ethenyl]phenyl]ethenyl]benzene?
1-methoxy-4-[2-[4-[2-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]ethenyl]phenyl]ethenyl]benzene has a molecular weight of 444.57 g/mol, XLogP of 8.22, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-4-[2-[4-[2-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]ethenyl]phenyl]ethenyl]benzene is sourced from PubChem (CID 76573307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).