2-ethenyl-1-ethoxy-3-(2-ethoxyphenyl)benzene

C18H20O2 — CID 69455028

IUPAC2-ethenyl-1-ethoxy-3-(2-ethoxyphenyl)benzene
SMILESC=Cc1c(OCC)cccc1-c1ccccc1OCC
InChIInChI=1S/C18H20O2/c1-4-14-15(11-9-13-17(14)19-5-2)16-10-7-8-12-18(16)20-6-3/h4,7-13H,1,5-6H2,2-3H3
InChIKeyLYNGKGSMKNHWKO-UHFFFAOYSA-N
MW268.36 g/mol
LogP4.79
Rot. Bonds6

About 2-ethenyl-1-ethoxy-3-(2-ethoxyphenyl)benzene

2-ethenyl-1-ethoxy-3-(2-ethoxyphenyl)benzene (PubChem CID 69455028) has the molecular formula C18H20O2 and a molecular weight of 268.36 g/mol. Its IUPAC name is 2-ethenyl-1-ethoxy-3-(2-ethoxyphenyl)benzene.

Molecular Properties

Compound Name2-ethenyl-1-ethoxy-3-(2-ethoxyphenyl)benzene
PubChem CID69455028
Molecular FormulaC18H20O2
Molecular Weight268.36 g/mol
Exact Mass268.15
IUPAC Name2-ethenyl-1-ethoxy-3-(2-ethoxyphenyl)benzene
SMILESC=Cc1c(OCC)cccc1-c1ccccc1OCC
InChIInChI=1S/C18H20O2/c1-4-14-15(11-9-13-17(14)19-5-2)16-10-7-8-12-18(16)20-6-3/h4,7-13H,1,5-6H2,2-3H3
InChIKeyLYNGKGSMKNHWKO-UHFFFAOYSA-N
XLogP4.79
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 54.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-ethoxyphenyl)-2-methoxy-4-prop-2-enylbenzene
CID 170842008
1-ethoxy-2-[4-(4-phenylphenyl)phenyl]benzene
CID 151505413
2-chloro-1-ethenyl-3-ethoxybenzene
CID 19358720
1-(2-ethoxyphenyl)-9H-carbazole
CID 175136892
4-(2-ethoxyphenyl)benzaldehyde
CID 62801534
4-(2-ethoxyphenyl)phenol
CID 83129672
4-(2-ethoxyphenyl)pyridine
CID 23466193
2-ethenyl-6-ethoxypyridine
CID 74889611
2-(2-ethoxyphenyl)-5-methylbenzaldehyde
CID 172649130
2-(2-ethoxyphenyl)-5-methylaniline
CID 82766449
2-(2-ethoxyphenyl)furan
CID 168524531
1-ethenyl-2-ethoxy-3-methoxybenzene
CID 11629687

Frequently Asked Questions

What is the IUPAC name of 2-ethenyl-1-ethoxy-3-(2-ethoxyphenyl)benzene?
The IUPAC name of 2-ethenyl-1-ethoxy-3-(2-ethoxyphenyl)benzene (CID 69455028) is 2-ethenyl-1-ethoxy-3-(2-ethoxyphenyl)benzene.
What is the SMILES notation for 2-ethenyl-1-ethoxy-3-(2-ethoxyphenyl)benzene?
The canonical SMILES for 2-ethenyl-1-ethoxy-3-(2-ethoxyphenyl)benzene is C=Cc1c(OCC)cccc1-c1ccccc1OCC.
What is the InChIKey of 2-ethenyl-1-ethoxy-3-(2-ethoxyphenyl)benzene?
The InChIKey is LYNGKGSMKNHWKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20O2/c1-4-14-15(11-9-13-17(14)19-5-2)16-10-7-8-12-18(16)20-6-3/h4,7-13H,1,5-6H2,2-3H3.
What are the key properties of 2-ethenyl-1-ethoxy-3-(2-ethoxyphenyl)benzene?
2-ethenyl-1-ethoxy-3-(2-ethoxyphenyl)benzene has a molecular weight of 268.36 g/mol, XLogP of 4.79, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-1-ethoxy-3-(2-ethoxyphenyl)benzene is sourced from PubChem (CID 69455028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).