1-ethoxy-2-(1-phenylethenyl)benzene

C16H16O — CID 162347910

IUPAC1-ethoxy-2-(1-phenylethenyl)benzene
SMILESC=C(c1ccccc1)c1ccccc1OCC
InChIInChI=1S/C16H16O/c1-3-17-16-12-8-7-11-15(16)13(2)14-9-5-4-6-10-14/h4-12H,2-3H2,1H3
InChIKeyJXPTWWVLYQUFJK-UHFFFAOYSA-N
MW224.30 g/mol
LogP4.15
Rot. Bonds4

About 1-ethoxy-2-(1-phenylethenyl)benzene

1-ethoxy-2-(1-phenylethenyl)benzene (PubChem CID 162347910) has the molecular formula C16H16O and a molecular weight of 224.30 g/mol. Its IUPAC name is 1-ethoxy-2-(1-phenylethenyl)benzene.

Molecular Properties

Compound Name1-ethoxy-2-(1-phenylethenyl)benzene
PubChem CID162347910
Molecular FormulaC16H16O
Molecular Weight224.30 g/mol
Exact Mass224.12
IUPAC Name1-ethoxy-2-(1-phenylethenyl)benzene
SMILESC=C(c1ccccc1)c1ccccc1OCC
InChIInChI=1S/C16H16O/c1-3-17-16-12-8-7-11-15(16)13(2)14-9-5-4-6-10-14/h4-12H,2-3H2,1H3
InChIKeyJXPTWWVLYQUFJK-UHFFFAOYSA-N
XLogP4.15
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 54.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-ethoxy-2-(1-phenylethenyl)benzene?
The IUPAC name of 1-ethoxy-2-(1-phenylethenyl)benzene (CID 162347910) is 1-ethoxy-2-(1-phenylethenyl)benzene.
What is the SMILES notation for 1-ethoxy-2-(1-phenylethenyl)benzene?
The canonical SMILES for 1-ethoxy-2-(1-phenylethenyl)benzene is C=C(c1ccccc1)c1ccccc1OCC.
What is the InChIKey of 1-ethoxy-2-(1-phenylethenyl)benzene?
The InChIKey is JXPTWWVLYQUFJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16O/c1-3-17-16-12-8-7-11-15(16)13(2)14-9-5-4-6-10-14/h4-12H,2-3H2,1H3.
What are the key properties of 1-ethoxy-2-(1-phenylethenyl)benzene?
1-ethoxy-2-(1-phenylethenyl)benzene has a molecular weight of 224.30 g/mol, XLogP of 4.15, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxy-2-(1-phenylethenyl)benzene is sourced from PubChem (CID 162347910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).