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

C16H16O — CID 151818646

IUPAC1-ethenyl-2-(3-ethoxyphenyl)benzene
SMILESC=Cc1ccccc1-c1cccc(OCC)c1
InChIInChI=1S/C16H16O/c1-3-13-8-5-6-11-16(13)14-9-7-10-15(12-14)17-4-2/h3,5-12H,1,4H2,2H3
InChIKeySCDVLUPJOQOLSU-UHFFFAOYSA-N
MW224.30 g/mol
LogP4.40
Rot. Bonds4

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

1-ethenyl-2-(3-ethoxyphenyl)benzene (PubChem CID 151818646) has the molecular formula C16H16O and a molecular weight of 224.30 g/mol. Its IUPAC name is 1-ethenyl-2-(3-ethoxyphenyl)benzene.

Molecular Properties

Compound Name1-ethenyl-2-(3-ethoxyphenyl)benzene
PubChem CID151818646
Molecular FormulaC16H16O
Molecular Weight224.30 g/mol
Exact Mass224.12
IUPAC Name1-ethenyl-2-(3-ethoxyphenyl)benzene
SMILESC=Cc1ccccc1-c1cccc(OCC)c1
InChIInChI=1S/C16H16O/c1-3-13-8-5-6-11-16(13)14-9-7-10-15(12-14)17-4-2/h3,5-12H,1,4H2,2H3
InChIKeySCDVLUPJOQOLSU-UHFFFAOYSA-N
XLogP4.40
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 ≤ 54.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 88533014
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2-(3-ethoxyphenyl)-6-fluoroaniline
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1,2-bis(ethenyl)-4-ethoxybenzene
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3-(3-ethoxyphenyl)-1H-pyridin-2-one
CID 53217766
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Frequently Asked Questions

What is the IUPAC name of 1-ethenyl-2-(3-ethoxyphenyl)benzene?
The IUPAC name of 1-ethenyl-2-(3-ethoxyphenyl)benzene (CID 151818646) is 1-ethenyl-2-(3-ethoxyphenyl)benzene.
What is the SMILES notation for 1-ethenyl-2-(3-ethoxyphenyl)benzene?
The canonical SMILES for 1-ethenyl-2-(3-ethoxyphenyl)benzene is C=Cc1ccccc1-c1cccc(OCC)c1.
What is the InChIKey of 1-ethenyl-2-(3-ethoxyphenyl)benzene?
The InChIKey is SCDVLUPJOQOLSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16O/c1-3-13-8-5-6-11-16(13)14-9-7-10-15(12-14)17-4-2/h3,5-12H,1,4H2,2H3.
What are the key properties of 1-ethenyl-2-(3-ethoxyphenyl)benzene?
1-ethenyl-2-(3-ethoxyphenyl)benzene has a molecular weight of 224.30 g/mol, XLogP of 4.40, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-2-(3-ethoxyphenyl)benzene is sourced from PubChem (CID 151818646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).