1,4-dimethoxy-2-(3-methoxyphenoxy)benzene

C15H16O4 — CID 95561214

IUPAC1,4-dimethoxy-2-(3-methoxyphenoxy)benzene
SMILESCOc1cccc(Oc2cc(OC)ccc2OC)c1
InChIInChI=1S/C15H16O4/c1-16-11-5-4-6-13(9-11)19-15-10-12(17-2)7-8-14(15)18-3/h4-10H,1-3H3
InChIKeyHDAMMZDTTFMYAG-UHFFFAOYSA-N
MW260.29 g/mol
LogP3.50
Rot. Bonds5

About 1,4-dimethoxy-2-(3-methoxyphenoxy)benzene

1,4-dimethoxy-2-(3-methoxyphenoxy)benzene (PubChem CID 95561214) has the molecular formula C15H16O4 and a molecular weight of 260.29 g/mol. Its IUPAC name is 1,4-dimethoxy-2-(3-methoxyphenoxy)benzene.

Molecular Properties

Compound Name1,4-dimethoxy-2-(3-methoxyphenoxy)benzene
PubChem CID95561214
Molecular FormulaC15H16O4
Molecular Weight260.29 g/mol
Exact Mass260.10
IUPAC Name1,4-dimethoxy-2-(3-methoxyphenoxy)benzene
SMILESCOc1cccc(Oc2cc(OC)ccc2OC)c1
InChIInChI=1S/C15H16O4/c1-16-11-5-4-6-13(9-11)19-15-10-12(17-2)7-8-14(15)18-3/h4-10H,1-3H3
InChIKeyHDAMMZDTTFMYAG-UHFFFAOYSA-N
XLogP3.50
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.29
LogP ≤ 53.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1,4-dimethoxy-2-(3-methoxyphenoxy)benzene?
The IUPAC name of 1,4-dimethoxy-2-(3-methoxyphenoxy)benzene (CID 95561214) is 1,4-dimethoxy-2-(3-methoxyphenoxy)benzene.
What is the SMILES notation for 1,4-dimethoxy-2-(3-methoxyphenoxy)benzene?
The canonical SMILES for 1,4-dimethoxy-2-(3-methoxyphenoxy)benzene is COc1cccc(Oc2cc(OC)ccc2OC)c1.
What is the InChIKey of 1,4-dimethoxy-2-(3-methoxyphenoxy)benzene?
The InChIKey is HDAMMZDTTFMYAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O4/c1-16-11-5-4-6-13(9-11)19-15-10-12(17-2)7-8-14(15)18-3/h4-10H,1-3H3.
What are the key properties of 1,4-dimethoxy-2-(3-methoxyphenoxy)benzene?
1,4-dimethoxy-2-(3-methoxyphenoxy)benzene has a molecular weight of 260.29 g/mol, XLogP of 3.50, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dimethoxy-2-(3-methoxyphenoxy)benzene is sourced from PubChem (CID 95561214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).