1-ethenyl-4-[(3-methoxyphenyl)methoxy]benzene

C16H16O2 — CID 142732471

IUPAC1-ethenyl-4-[(3-methoxyphenyl)methoxy]benzene
SMILESC=Cc1ccc(OCc2cccc(OC)c2)cc1
InChIInChI=1S/C16H16O2/c1-3-13-7-9-15(10-8-13)18-12-14-5-4-6-16(11-14)17-2/h3-11H,1,12H2,2H3
InChIKeyHWPBRFUOHKPHCU-UHFFFAOYSA-N
MW240.30 g/mol
LogP3.92
Rot. Bonds5

About 1-ethenyl-4-[(3-methoxyphenyl)methoxy]benzene

1-ethenyl-4-[(3-methoxyphenyl)methoxy]benzene (PubChem CID 142732471) has the molecular formula C16H16O2 and a molecular weight of 240.30 g/mol. Its IUPAC name is 1-ethenyl-4-[(3-methoxyphenyl)methoxy]benzene.

Molecular Properties

Compound Name1-ethenyl-4-[(3-methoxyphenyl)methoxy]benzene
PubChem CID142732471
Molecular FormulaC16H16O2
Molecular Weight240.30 g/mol
Exact Mass240.12
IUPAC Name1-ethenyl-4-[(3-methoxyphenyl)methoxy]benzene
SMILESC=Cc1ccc(OCc2cccc(OC)c2)cc1
InChIInChI=1S/C16H16O2/c1-3-13-7-9-15(10-8-13)18-12-14-5-4-6-16(11-14)17-2/h3-11H,1,12H2,2H3
InChIKeyHWPBRFUOHKPHCU-UHFFFAOYSA-N
XLogP3.92
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.30
LogP ≤ 53.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-ethenyl-4-[(3-methoxyphenyl)methoxy]benzene?
The IUPAC name of 1-ethenyl-4-[(3-methoxyphenyl)methoxy]benzene (CID 142732471) is 1-ethenyl-4-[(3-methoxyphenyl)methoxy]benzene.
What is the SMILES notation for 1-ethenyl-4-[(3-methoxyphenyl)methoxy]benzene?
The canonical SMILES for 1-ethenyl-4-[(3-methoxyphenyl)methoxy]benzene is C=Cc1ccc(OCc2cccc(OC)c2)cc1.
What is the InChIKey of 1-ethenyl-4-[(3-methoxyphenyl)methoxy]benzene?
The InChIKey is HWPBRFUOHKPHCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16O2/c1-3-13-7-9-15(10-8-13)18-12-14-5-4-6-16(11-14)17-2/h3-11H,1,12H2,2H3.
What are the key properties of 1-ethenyl-4-[(3-methoxyphenyl)methoxy]benzene?
1-ethenyl-4-[(3-methoxyphenyl)methoxy]benzene has a molecular weight of 240.30 g/mol, XLogP of 3.92, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-4-[(3-methoxyphenyl)methoxy]benzene is sourced from PubChem (CID 142732471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).