1,3,4-trimethoxydibenzofuran-2,6-diol

C15H14O6 — CID 10424294

IUPAC1,3,4-trimethoxydibenzofuran-2,6-diol
SMILESCOc1c(O)c(OC)c2c(oc3c(O)cccc32)c1OC
InChIInChI=1S/C15H14O6/c1-18-12-9-7-5-4-6-8(16)11(7)21-13(9)15(20-3)14(19-2)10(12)17/h4-6,16-17H,1-3H3
InChIKeyXUGBHEYCYSYJSM-UHFFFAOYSA-N
MW290.27 g/mol
LogP3.02
Rot. Bonds3

About 1,3,4-trimethoxydibenzofuran-2,6-diol

1,3,4-trimethoxydibenzofuran-2,6-diol (PubChem CID 10424294) has the molecular formula C15H14O6 and a molecular weight of 290.27 g/mol. Its IUPAC name is 1,3,4-trimethoxydibenzofuran-2,6-diol.

Molecular Properties

Compound Name1,3,4-trimethoxydibenzofuran-2,6-diol
PubChem CID10424294
Molecular FormulaC15H14O6
Molecular Weight290.27 g/mol
Exact Mass290.08
IUPAC Name1,3,4-trimethoxydibenzofuran-2,6-diol
SMILESCOc1c(O)c(OC)c2c(oc3c(O)cccc32)c1OC
InChIInChI=1S/C15H14O6/c1-18-12-9-7-5-4-6-8(16)11(7)21-13(9)15(20-3)14(19-2)10(12)17/h4-6,16-17H,1-3H3
InChIKeyXUGBHEYCYSYJSM-UHFFFAOYSA-N
XLogP3.02
TPSA81.29 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.27
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1,3,4-trimethoxydibenzofuran-2,6-diol?
The IUPAC name of 1,3,4-trimethoxydibenzofuran-2,6-diol (CID 10424294) is 1,3,4-trimethoxydibenzofuran-2,6-diol.
What is the SMILES notation for 1,3,4-trimethoxydibenzofuran-2,6-diol?
The canonical SMILES for 1,3,4-trimethoxydibenzofuran-2,6-diol is COc1c(O)c(OC)c2c(oc3c(O)cccc32)c1OC.
What is the InChIKey of 1,3,4-trimethoxydibenzofuran-2,6-diol?
The InChIKey is XUGBHEYCYSYJSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14O6/c1-18-12-9-7-5-4-6-8(16)11(7)21-13(9)15(20-3)14(19-2)10(12)17/h4-6,16-17H,1-3H3.
What are the key properties of 1,3,4-trimethoxydibenzofuran-2,6-diol?
1,3,4-trimethoxydibenzofuran-2,6-diol has a molecular weight of 290.27 g/mol, XLogP of 3.02, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,4-trimethoxydibenzofuran-2,6-diol is sourced from PubChem (CID 10424294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).