7-ethenyl-1,2,6-trimethoxynaphthalene

C15H16O3 — CID 66593812

IUPAC7-ethenyl-1,2,6-trimethoxynaphthalene
SMILESC=Cc1cc2c(OC)c(OC)ccc2cc1OC
InChIInChI=1S/C15H16O3/c1-5-10-8-12-11(9-14(10)17-3)6-7-13(16-2)15(12)18-4/h5-9H,1H2,2-4H3
InChIKeyVIQCEKZDUQKMKD-UHFFFAOYSA-N
MW244.29 g/mol
LogP3.51
Rot. Bonds4

About 7-ethenyl-1,2,6-trimethoxynaphthalene

7-ethenyl-1,2,6-trimethoxynaphthalene (PubChem CID 66593812) has the molecular formula C15H16O3 and a molecular weight of 244.29 g/mol. Its IUPAC name is 7-ethenyl-1,2,6-trimethoxynaphthalene.

Molecular Properties

Compound Name7-ethenyl-1,2,6-trimethoxynaphthalene
PubChem CID66593812
Molecular FormulaC15H16O3
Molecular Weight244.29 g/mol
Exact Mass244.11
IUPAC Name7-ethenyl-1,2,6-trimethoxynaphthalene
SMILESC=Cc1cc2c(OC)c(OC)ccc2cc1OC
InChIInChI=1S/C15H16O3/c1-5-10-8-12-11(9-14(10)17-3)6-7-13(16-2)15(12)18-4/h5-9H,1H2,2-4H3
InChIKeyVIQCEKZDUQKMKD-UHFFFAOYSA-N
XLogP3.51
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 53.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-ethenyl-1,2,6-trimethoxynaphthalene?
The IUPAC name of 7-ethenyl-1,2,6-trimethoxynaphthalene (CID 66593812) is 7-ethenyl-1,2,6-trimethoxynaphthalene.
What is the SMILES notation for 7-ethenyl-1,2,6-trimethoxynaphthalene?
The canonical SMILES for 7-ethenyl-1,2,6-trimethoxynaphthalene is C=Cc1cc2c(OC)c(OC)ccc2cc1OC.
What is the InChIKey of 7-ethenyl-1,2,6-trimethoxynaphthalene?
The InChIKey is VIQCEKZDUQKMKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O3/c1-5-10-8-12-11(9-14(10)17-3)6-7-13(16-2)15(12)18-4/h5-9H,1H2,2-4H3.
What are the key properties of 7-ethenyl-1,2,6-trimethoxynaphthalene?
7-ethenyl-1,2,6-trimethoxynaphthalene has a molecular weight of 244.29 g/mol, XLogP of 3.51, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethenyl-1,2,6-trimethoxynaphthalene is sourced from PubChem (CID 66593812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).