1-(2-ethoxyethoxy)-4-[(E)-2-[4-(2-ethoxyethoxy)phenyl]ethenyl]benzene

C22H28O4 — CID 134394196

IUPAC1-(2-ethoxyethoxy)-4-[(E)-2-[4-(2-ethoxyethoxy)phenyl]ethenyl]benzene
SMILESCCOCCOc1ccc(/C=C/c2ccc(OCCOCC)cc2)cc1
InChIInChI=1S/C22H28O4/c1-3-23-15-17-25-21-11-7-19(8-12-21)5-6-20-9-13-22(14-10-20)26-18-16-24-4-2/h5-14H,3-4,15-18H2,1-2H3/b6-5+
InChIKeyFBUGFQQKXZJTMD-AATRIKPKSA-N
MW356.46 g/mol
LogP4.69
Rot. Bonds12

About 1-(2-ethoxyethoxy)-4-[(E)-2-[4-(2-ethoxyethoxy)phenyl]ethenyl]benzene

1-(2-ethoxyethoxy)-4-[(E)-2-[4-(2-ethoxyethoxy)phenyl]ethenyl]benzene (PubChem CID 134394196) has the molecular formula C22H28O4 and a molecular weight of 356.46 g/mol. Its IUPAC name is 1-(2-ethoxyethoxy)-4-[(E)-2-[4-(2-ethoxyethoxy)phenyl]ethenyl]benzene.

Molecular Properties

Compound Name1-(2-ethoxyethoxy)-4-[(E)-2-[4-(2-ethoxyethoxy)phenyl]ethenyl]benzene
PubChem CID134394196
Molecular FormulaC22H28O4
Molecular Weight356.46 g/mol
Exact Mass356.20
IUPAC Name1-(2-ethoxyethoxy)-4-[(E)-2-[4-(2-ethoxyethoxy)phenyl]ethenyl]benzene
SMILESCCOCCOc1ccc(/C=C/c2ccc(OCCOCC)cc2)cc1
InChIInChI=1S/C22H28O4/c1-3-23-15-17-25-21-11-7-19(8-12-21)5-6-20-9-13-22(14-10-20)26-18-16-24-4-2/h5-14H,3-4,15-18H2,1-2H3/b6-5+
InChIKeyFBUGFQQKXZJTMD-AATRIKPKSA-N
XLogP4.69
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds12
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.46
LogP ≤ 54.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-[4-(2-ethoxyethoxy)phenyl]benzaldehyde
CID 145127108
4-[(E)-2-[4-[2-(2-ethoxyethoxy)ethoxy]phenyl]ethenyl]-N,N-dimethyl-2-methyliodanuidylaniline
CID 158958056
4-[(E)-2-[4-[2-[2-[4-[(E)-2-(4-aminophenyl)ethenyl]phenoxy]ethoxy]ethoxy]phenyl]ethenyl]aniline
CID 154936794
2-ethenyl-6-(2-ethoxyethoxy)naphthalene
CID 68832000
4-(2-ethoxyethoxy)aniline
CID 16641299
4-[(E)-2-[4-[2-[2-[2-[2-[2-[4-[(E)-2-pyridin-4-ylethenyl]phenoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]phenyl]ethenyl]pyridine
CID 102398908
1-(2-ethoxyethyl)-4-[2-[2-[4-(2-ethoxyethyl)phenoxy]ethoxy]ethoxy]benzene
CID 70366041
1-(2-ethoxyethoxy)-4-methylsulfanylbenzene
CID 57317041
1-ethoxy-4-(2-phenylethenyl)benzene
CID 54277622
benzene-1,3-diol;4-(2-ethoxyethoxy)benzaldehyde
CID 173298642
4-(2-ethoxyethoxy)-N-ethylaniline
CID 54801151
4-[2-(4-ethoxyphenyl)ethenyl]-N,N-dimethylaniline
CID 67837040

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethoxyethoxy)-4-[(E)-2-[4-(2-ethoxyethoxy)phenyl]ethenyl]benzene?
The IUPAC name of 1-(2-ethoxyethoxy)-4-[(E)-2-[4-(2-ethoxyethoxy)phenyl]ethenyl]benzene (CID 134394196) is 1-(2-ethoxyethoxy)-4-[(E)-2-[4-(2-ethoxyethoxy)phenyl]ethenyl]benzene.
What is the SMILES notation for 1-(2-ethoxyethoxy)-4-[(E)-2-[4-(2-ethoxyethoxy)phenyl]ethenyl]benzene?
The canonical SMILES for 1-(2-ethoxyethoxy)-4-[(E)-2-[4-(2-ethoxyethoxy)phenyl]ethenyl]benzene is CCOCCOc1ccc(/C=C/c2ccc(OCCOCC)cc2)cc1.
What is the InChIKey of 1-(2-ethoxyethoxy)-4-[(E)-2-[4-(2-ethoxyethoxy)phenyl]ethenyl]benzene?
The InChIKey is FBUGFQQKXZJTMD-AATRIKPKSA-N. The full InChI is InChI=1S/C22H28O4/c1-3-23-15-17-25-21-11-7-19(8-12-21)5-6-20-9-13-22(14-10-20)26-18-16-24-4-2/h5-14H,3-4,15-18H2,1-2H3/b6-5+.
What are the key properties of 1-(2-ethoxyethoxy)-4-[(E)-2-[4-(2-ethoxyethoxy)phenyl]ethenyl]benzene?
1-(2-ethoxyethoxy)-4-[(E)-2-[4-(2-ethoxyethoxy)phenyl]ethenyl]benzene has a molecular weight of 356.46 g/mol, XLogP of 4.69, 12 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethoxyethoxy)-4-[(E)-2-[4-(2-ethoxyethoxy)phenyl]ethenyl]benzene is sourced from PubChem (CID 134394196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).