2-ethenyl-1,4-bis(1-ethoxyethoxy)benzene

C16H24O4 — CID 102247848

IUPAC2-ethenyl-1,4-bis(1-ethoxyethoxy)benzene
SMILESC=Cc1cc(OC(C)OCC)ccc1OC(C)OCC
InChIInChI=1S/C16H24O4/c1-6-14-11-15(19-12(4)17-7-2)9-10-16(14)20-13(5)18-8-3/h6,9-13H,1,7-8H2,2-5H3
InChIKeyMUAGGMLAZWJSMO-UHFFFAOYSA-N
MW280.36 g/mol
LogP3.85
Rot. Bonds9

About 2-ethenyl-1,4-bis(1-ethoxyethoxy)benzene

2-ethenyl-1,4-bis(1-ethoxyethoxy)benzene (PubChem CID 102247848) has the molecular formula C16H24O4 and a molecular weight of 280.36 g/mol. Its IUPAC name is 2-ethenyl-1,4-bis(1-ethoxyethoxy)benzene.

Molecular Properties

Compound Name2-ethenyl-1,4-bis(1-ethoxyethoxy)benzene
PubChem CID102247848
Molecular FormulaC16H24O4
Molecular Weight280.36 g/mol
Exact Mass280.17
IUPAC Name2-ethenyl-1,4-bis(1-ethoxyethoxy)benzene
SMILESC=Cc1cc(OC(C)OCC)ccc1OC(C)OCC
InChIInChI=1S/C16H24O4/c1-6-14-11-15(19-12(4)17-7-2)9-10-16(14)20-13(5)18-8-3/h6,9-13H,1,7-8H2,2-5H3
InChIKeyMUAGGMLAZWJSMO-UHFFFAOYSA-N
XLogP3.85
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.36
LogP ≤ 53.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-ethenyl-1,4-bis(1-ethoxyethoxy)benzene?
The IUPAC name of 2-ethenyl-1,4-bis(1-ethoxyethoxy)benzene (CID 102247848) is 2-ethenyl-1,4-bis(1-ethoxyethoxy)benzene.
What is the SMILES notation for 2-ethenyl-1,4-bis(1-ethoxyethoxy)benzene?
The canonical SMILES for 2-ethenyl-1,4-bis(1-ethoxyethoxy)benzene is C=Cc1cc(OC(C)OCC)ccc1OC(C)OCC.
What is the InChIKey of 2-ethenyl-1,4-bis(1-ethoxyethoxy)benzene?
The InChIKey is MUAGGMLAZWJSMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24O4/c1-6-14-11-15(19-12(4)17-7-2)9-10-16(14)20-13(5)18-8-3/h6,9-13H,1,7-8H2,2-5H3.
What are the key properties of 2-ethenyl-1,4-bis(1-ethoxyethoxy)benzene?
2-ethenyl-1,4-bis(1-ethoxyethoxy)benzene has a molecular weight of 280.36 g/mol, XLogP of 3.85, 9 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-1,4-bis(1-ethoxyethoxy)benzene is sourced from PubChem (CID 102247848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).